1-[(5-amino-2-methoxyphenyl)methyl]pyrrolidin-2-one hydrochloride

1-[(5-amino-2-methoxyphenyl)methyl]pyrrolidin-2-one hydrochloride

CAS: 1185294-41-0

Formula: C12H17ClN2O2

SMILES: Cl.COC1=C(CN2CCCC2=O)C=C(N)C=C1

IUPAC: 1-[(5-amino-2-methoxyphenyl)methyl]pyrrolidin-2-one hydrochloride

InChI: InChI=1S/C12H16N2O2.ClH/c1-16-11-5-4-10(13)7-9(11)8-14-6-2-3-12(14)15;/h4-5,7H,2-3,6,8,13H2,1H3;1H

Composition: C (56.14%), H (6.67%), Cl (13.81%), N (10.91%), O (12.46%)

Molar Mass: 256.73

Atom Count: 34

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	256.0978555
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CSHKOQFEJVGPEC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.93
Topological Polar Surface Area	55.56
Polarizability	23.67
Ring Count	2
Rotatable Bond Count	3

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