5-(Dimethylamino)-1-indanone,ZINC00173336,1H-Inden-1-one, 5-(dimethyla

[Synonyms]
5-(Dimethylamino)-1-indanone
ZINC00173336
1H-Inden-1-one, 5-(dimethylamino)-2,3-dihydro-

[Structure]

[ Properties Computed from Structure]

Molecular Weight	175.22702 [g/mol]
Molecular Formula	C11H13NO
XLogP	1.7
H-Bond Donor	0
H-Bond Acceptor	2
Rotatable Bond Count	1
Tautomer Count	2
Exact Mass	175.099714
MonoIsotopic Mass	175.099714
Topological Polar Surface Area	20.3
Heavy Atom Count	13
Formal Charge	0
Complexity	212
Isotope Atom Count	0
Defined Atom StereoCenter Count	0
Undefined Atom StereoCenter Count	0
Defined Bond StereoCenter Count	0
Undefined Bond StereoCenter Count	0
Covalently-Bonded Unit Count	1

[ Descriptors Computed from Structure]
IUPAC Name: 5-dimethylamino-2,3-dihydroinden-1-one
Canonical SMILES: CN(C)C1=CC2=C(C=C1)C(=O)CC2
InChI: InChI=1/C11H13NO/c1-12(2)9-4-5-10-8(7-9)3-6-11(10)13/h4-5,7H,3,6H2,1-2H3