6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one

C19H17N3O — CID 14373260

IUPAC6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C(c3ccccc3)n3ccnc3)ccc2N1
InChIInChI=1S/C19H17N3O/c23-18-9-7-15-12-16(6-8-17(15)21-18)19(22-11-10-20-13-22)14-4-2-1-3-5-14/h1-6,8,10-13,19H,7,9H2,(H,21,23)
InChIKeyRVFWZZNOQSIYGX-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.41
Rot. Bonds3

About 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one

6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 14373260) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID14373260
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C(c3ccccc3)n3ccnc3)ccc2N1
InChIInChI=1S/C19H17N3O/c23-18-9-7-15-12-16(6-8-17(15)21-18)19(22-11-10-20-13-22)14-4-2-1-3-5-14/h1-6,8,10-13,19H,7,9H2,(H,21,23)
InChIKeyRVFWZZNOQSIYGX-UHFFFAOYSA-N
XLogP3.41
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-Imidazol-1-yl-3,4-dihydro-1H-quinolin-2-one
CID 13885278
6-(2-Imidazol-1-yl-vinyl)-1H-quinolin-2-one
CID 14373279
N-[4-(1H-imidazol-1-ylmethyl)phenyl]-3-(trifluoromethyl)benzamide
CID 1508858
1-Cycloheptyl-1-[(4-imidazol-1-ylphenyl)methyl]-3-(2,4,6-trimethylphenyl)urea
CID 10574677
3-(5-Imidazol-1-yl-pentyl)-1H-quinazoline-2,4-dione
CID 13952771
3-(3-Imidazol-1-yl-butyl)-6-methyl-1H-quinazoline-2,4-dione
CID 13952801
N-(1-benzylpiperidin-4-yl)-4-imidazol-1-ylbenzamide
CID 14664367
4-Imidazol-1-yl-N-(4-phenyl-piperazin-2-ylmethyl)-benzamide
CID 14998848
6-[(4-Chloro-phenyl)-imidazol-1-yl-methyl]-4-phenyl-1H-quinolin-2-one
CID 15484952
4-(3-Imidazol-1-yl-phenyl)-8-phenyl-1,3-dihydro-benzo[b][1,4]diazepin-2-one
CID 22224570
8-Imidazol-1-yl-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinolin-4-one
CID 44479646
6-(1-Imidazol-1-ylethyl)-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one
CID 44479884

Frequently Asked Questions

What is the IUPAC name of 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one (CID 14373260) is 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(C(c3ccccc3)n3ccnc3)ccc2N1.
What is the InChIKey of 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is RVFWZZNOQSIYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c23-18-9-7-15-12-16(6-8-17(15)21-18)19(22-11-10-20-13-22)14-4-2-1-3-5-14/h1-6,8,10-13,19H,7,9H2,(H,21,23).
What are the key properties of 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one?
6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 303.37 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[imidazol-1-yl(phenyl)methyl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 14373260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).