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3-Methylbutanamide

3-Methylbutanamide structure

CAS No:
541-46-8
Formula:
C5H11NO
Chemical Name:
3-Methylbutanamide
Synonyms:
Butanamide,3-methyl-;Isovaleramide;3-Methylbutanamide;Isovaleric acid amide;3-Methylbutyramide;β-Methylbutyramide;Isopentanamide;NSC 402555;NPS 1776;502641-01-2
Categories:
Biochemical Engineering > Inhibitors

Description

Isovaleramide is an active principle on central nervous system from Valeriana pavonii, as an anticonvulsant.Target：in vitro: Isovaleramide (300 μM) exhibits a 42% of inhibition of the binding of 3H-FNZ to its sites.in vivo: Isovaleramide at 100 mg/Kg, p.o, evidences a 90% index protection against the maximal electroshock seizure in mice (MES).

3-Methylbutanamide Basic Attributes

Molecular Weight：

101.15

Exact Mass：

101.15

BRN：

1740789

EC Number：

208-781-1

UNII：

9CP4KB634M

NSC Number：

760408|402555

DSSTox ID：

DTXSID3060249

HScode：

2924199090

Characteristics

PSA：

43.1

XLogP3：

1.21810

Density：

0.901g/cm3

Melting Point：

137 °C

Boiling Point：

226 °C

Flash Point：

232°C

Refractive Index：

1.425

Safety Information

safety instructions：

22-24/25

RTECS Number：

EJ3650000

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

3-methylbutyramide

3-Methylbutanamide Use and Manufacturing

Uses

RT transferase inhibitor, antiviral

Manufacturing Info：

Butanamide, 3-methyl-: ACTIVE

Computed Properties

Molecular Weight:101.15
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:101.084063974
Monoisotopic Mass:101.084063974
Topological Polar Surface Area:43.1
Heavy Atom Count:7
Complexity:68.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Isovaleramide

CAS No.: 541-46-8

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