3-(methylamino)propanenitrile

3-(methylamino)propanenitrile

CAS: 693-05-0

Formula: C4H8N2

SMILES: CNCCC#N

IUPAC: 3-(methylamino)propanenitrile

InChI: InChI=1S/C4H8N2/c1-6-4-2-3-5/h6H,2,4H2,1H3

Composition: C (57.11%), H (9.59%), N (33.30%)

Molar Mass: 84.122

Atom Count: 14

Heavy Atom Count: 6

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	84.068748266
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UNIJBMUBHBAUET-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	24.46
Topological Polar Surface Area	35.82
Polarizability	9.46
Ring Count	0
Rotatable Bond Count	2

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