2-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxylic acid

2-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxylic acid

CAS: 904816-69-9

Formula: C16H16N2O2

SMILES: OC(=O)C1=CC=CN=C1N1CCCC1C1=CC=CC=C1

IUPAC: 2-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxylic acid

InChI: InChI=1/C16H16N2O2/c19-16(20)13-8-4-10-17-15(13)18-11-5-9-14(18)12-6-2-1-3-7-12/h1-4,6-8,10,14H,5,9,11H2,(H,19,20)

Composition: C (71.62%), H (6.01%), N (10.44%), O (11.93%)

Molar Mass: 268.316

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	268.121177763
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PINOXEVUPOYFIX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.72
Topological Polar Surface Area	53.43
Polarizability	29.12
Ring Count	3
Rotatable Bond Count	3

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