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1-(3-aminopropyl)pyridin-2-one hydrochloride

1-(3-aminopropyl)pyridin-2-one hydrochloride

CAS: 1172380-14-1

Formula: C8H13ClN2O

SMILES: Cl[H].NCCCN1C=CC=CC1=O

IUPAC: 1-(3-aminopropyl)-1,2-dihydropyridin-2-one hydrochloride

InChI: InChI=1S/C8H12N2O.ClH/c9-5-3-7-10-6-2-1-4-8(10)11;/h1-2,4,6H,3,5,7,9H2;1H

Composition: C (50.93%), H (6.95%), Cl (18.79%), N (14.85%), O (8.48%)

Molar Mass: 188.66

Atom Count: 25

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 188.0716407
Formal Charge 0
FSP3 0.37
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZWKIRJQMDJQFGK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.76
Topological Polar Surface Area 46.33
Polarizability 16.99
Ring Count 1
Rotatable Bond Count 3

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