6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one

C17H18N2O — CID 86342359

IUPAC6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one
SMILESCCc1cccc(Nc2ccc3c(c2)CCC(=O)N3)c1
InChIInChI=1S/C17H18N2O/c1-2-12-4-3-5-14(10-12)18-15-7-8-16-13(11-15)6-9-17(20)19-16/h3-5,7-8,10-11,18H,2,6,9H2,1H3,(H,19,20)
InChIKeyDFRFQWLZODPLGT-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.88
Rot. Bonds3

About 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one

6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 86342359) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one
PubChem CID86342359
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one
SMILESCCc1cccc(Nc2ccc3c(c2)CCC(=O)N3)c1
InChIInChI=1S/C17H18N2O/c1-2-12-4-3-5-14(10-12)18-15-7-8-16-13(11-15)6-9-17(20)19-16/h3-5,7-8,10-11,18H,2,6,9H2,1H3,(H,19,20)
InChIKeyDFRFQWLZODPLGT-UHFFFAOYSA-N
XLogP3.88
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6(5H)-Phenanthridinone
CID 1853
Hydrocarbostyril
CID 64796
PJ-34
CID 4858
N-(1-Naphthyl)hexanamide
CID 532117
2-aminophenanthridin-6(5H)-one
CID 270668
Propanamide, N-(3-methylphenyl)-3-phenyl-
CID 532827
N-(2-Methylphenyl)benzeneacetamide
CID 38661
N-(1-phenyl-3,4-dihydro-2H-quinolin-3-yl)propanamide
CID 137637884
N-[4-(3,4-Dihydro-2H-quinoline-1-carbonyl)-phenyl]-acetamide
CID 669479
4-(3-Fluoro-phenyl)-6,7-dimethyl-3,4-dihydro-1H-quinolin-2-one
CID 3149754
N-(2,3-dimethylphenyl)-3-phenylpropanamide
CID 795944
Upcmld05admt002042
CID 316235

Frequently Asked Questions

What is the IUPAC name of 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one (CID 86342359) is 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one is CCc1cccc(Nc2ccc3c(c2)CCC(=O)N3)c1.
What is the InChIKey of 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is DFRFQWLZODPLGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-2-12-4-3-5-14(10-12)18-15-7-8-16-13(11-15)6-9-17(20)19-16/h3-5,7-8,10-11,18H,2,6,9H2,1H3,(H,19,20).
What are the key properties of 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one?
6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 266.34 g/mol, XLogP of 3.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethylanilino)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 86342359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).