4-(benzylamino)cyclohexan-1-one

4-(benzylamino)cyclohexan-1-one

CAS: 142009-99-2

Formula: C13H17NO

SMILES: O=C1CCC(CC1)NCC1=CC=CC=C1

IUPAC: 4-(benzylamino)cyclohexan-1-one

InChI: InChI=1S/C13H17NO/c15-13-8-6-12(7-9-13)14-10-11-4-2-1-3-5-11/h1-5,12,14H,6-10H2

Composition: C (76.81%), H (8.43%), N (6.89%), O (7.87%)

Molar Mass: 203.285

Atom Count: 32

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	203.131014171
Formal Charge	0
FSP3	0.46
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NMCDGVLRNAILQW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.96
Topological Polar Surface Area	29.1
Polarizability	24.1
Ring Count	2
Rotatable Bond Count	3

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