2-[(3-methoxypropyl)amino]pyridine-3-carbonitrile

2-[(3-methoxypropyl)amino]pyridine-3-carbonitrile

CAS: 945298-39-5

Formula: C10H13N3O

SMILES: COCCCNC1=NC=CC=C1C#N

IUPAC: 2-[(3-methoxypropyl)amino]pyridine-3-carbonitrile

InChI: InChI=1S/C10H13N3O/c1-14-7-3-6-13-10-9(8-11)4-2-5-12-10/h2,4-5H,3,6-7H2,1H3,(H,12,13)

Composition: C (62.81%), H (6.85%), N (21.97%), O (8.37%)

Molar Mass: 191.234

Atom Count: 27

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	191.105862051
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	VNKLSMVFMKEQEQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.04
Topological Polar Surface Area	57.94
Polarizability	20.46
Ring Count	1
Rotatable Bond Count	5

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