1-(pyridin-4-ylmethyl)piperidine-4-carboxylic acid dihydrochloride

1-(pyridin-4-ylmethyl)piperidine-4-carboxylic acid dihydrochloride

CAS: 1172453-94-9

Formula: C12H18Cl2N2O2

SMILES: Cl.Cl.OC(=O)C1CCN(CC2=CC=NC=C2)CC1

IUPAC: 1-[(pyridin-4-yl)methyl]piperidine-4-carboxylic acid dihydrochloride

InChI: InChI=1S/C12H16N2O2.2ClH/c15-12(16)11-3-7-14(8-4-11)9-10-1-5-13-6-2-10;;/h1-2,5-6,11H,3-4,7-9H2,(H,15,16);2*1H

Composition: C (49.16%), H (6.19%), Cl (24.18%), N (9.55%), O (10.91%)

Molar Mass: 293.19

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	292.0745332
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	IAAZFXXMRGZLOF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.83
Topological Polar Surface Area	53.43
Polarizability	23.63
Ring Count	2
Rotatable Bond Count	3

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