2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid

2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid

CAS: 414872-66-5

Formula: C12H19NO3

SMILES: OC(=O)C1CCCCC1C(=O)N1CCCC1

IUPAC: 2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid

InChI: InChI=1/C12H19NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h9-10H,1-8H2,(H,15,16)

Composition: C (63.98%), H (8.50%), N (6.22%), O (21.30%)

Molar Mass: 225.288

Atom Count: 35

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	225.136493476
Formal Charge	0
FSP3	0.83
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZOLDEFAIBWNKIN-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.24
Topological Polar Surface Area	57.61
Polarizability	23.14
Ring Count	2
Rotatable Bond Count	2

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