1-(3-nitropyridin-2-yl)piperidin-4-ol hydrochloride

1-(3-nitropyridin-2-yl)piperidin-4-ol hydrochloride

CAS: 1170160-07-2

Formula: C10H14ClN3O3

SMILES: Cl.OC1CCN(CC1)C1=NC=CC=C1[N+]([O-])=O

IUPAC: 1-(3-nitropyridin-2-yl)piperidin-4-ol hydrochloride

InChI: InChI=1S/C10H13N3O3.ClH/c14-8-3-6-12(7-4-8)10-9(13(15)16)2-1-5-11-10;/h1-2,5,8,14H,3-4,6-7H2;1H

Composition: C (46.25%), H (5.43%), Cl (13.65%), N (16.18%), O (18.48%)

Molar Mass: 259.69

Atom Count: 31

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	259.072369
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	KUAHJGZVQYWCKV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.69
Topological Polar Surface Area	79.5
Polarizability	21.61
Ring Count	2
Rotatable Bond Count	2

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