1,4-diazepan-2-one hydrochloride

1,4-diazepan-2-one hydrochloride

CAS: 1056010-05-9

Formula: C5H11ClN2O

SMILES: Cl.O=C1CNCCCN1

IUPAC: 1,4-diazepan-2-one hydrochloride

InChI: InChI=1S/C5H10N2O.ClH/c8-5-4-6-2-1-3-7-5;/h6H,1-4H2,(H,7,8);1H

Composition: C (39.88%), H (7.36%), Cl (23.54%), N (18.60%), O (10.62%)

Molar Mass: 150.61

Atom Count: 20

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	150.0559907
Formal Charge	0
FSP3	0.8
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	AMPBCAMPFHRYOB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	30.39
Topological Polar Surface Area	41.13
Polarizability	11.96
Ring Count	1
Rotatable Bond Count	0

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