2-(piperidin-1-yl)benzonitrile

2-(piperidin-1-yl)benzonitrile

CAS: 72752-52-4

Formula: C12H14N2

SMILES: N#CC1=CC=CC=C1N1CCCCC1

IUPAC: 2-(piperidin-1-yl)benzonitrile

InChI: InChI=1S/C12H14N2/c13-10-11-6-2-3-7-12(11)14-8-4-1-5-9-14/h2-3,6-7H,1,4-5,8-9H2

Composition: C (77.38%), H (7.58%), N (15.04%)

Molar Mass: 186.258

Atom Count: 28

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	186.115698459
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MEBVSLLKZSAIGK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.35
Topological Polar Surface Area	27.03
Polarizability	21.79
Ring Count	2
Rotatable Bond Count	1

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