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

C16H11Cl2NO2 — CID 43160665

IUPAC6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C(=O)c3c(Cl)cccc3Cl)ccc2N1
InChIInChI=1S/C16H11Cl2NO2/c17-11-2-1-3-12(18)15(11)16(21)10-4-6-13-9(8-10)5-7-14(20)19-13/h1-4,6,8H,5,7H2,(H,19,20)
InChIKeyRGRIACVTAQCZEJ-UHFFFAOYSA-N
MW320.18 g/mol
LogP4.11
Rot. Bonds2

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

6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43160665) has the molecular formula C16H11Cl2NO2 and a molecular weight of 320.18 g/mol. Its IUPAC name is 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID43160665
Molecular FormulaC16H11Cl2NO2
Molecular Weight320.18 g/mol
Exact Mass319.02
IUPAC Name6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(C(=O)c3c(Cl)cccc3Cl)ccc2N1
InChIInChI=1S/C16H11Cl2NO2/c17-11-2-1-3-12(18)15(11)16(21)10-4-6-13-9(8-10)5-7-14(20)19-13/h1-4,6,8H,5,7H2,(H,19,20)
InChIKeyRGRIACVTAQCZEJ-UHFFFAOYSA-N
XLogP4.11
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.18
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(3-amino-2-chlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one
CID 115937318
6-[2-(2,3-dichlorophenoxy)acetyl]-3,4-dihydro-1H-quinolin-2-one
CID 51183735
6-(3-bromo-5-chlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one
CID 107949673
6-(pyrrole-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 70502328
6-(3,5-dibromobenzoyl)-3,4-dihydro-1H-quinolin-2-one
CID 107979594
N-[(3-chloro-2-fluorophenyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 172894844
6-(2-amino-2-methylpropanoyl)-3,4-dihydro-1H-quinolin-2-one
CID 116915356
methyl 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate
CID 9451992
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 17497686
6-(cyclohexanecarbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 43160672
2-chloro-6-fluoro-N-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]benzamide
CID 110781570
N-[(3-chlorophenyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 86911732

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one (CID 43160665) is 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(C(=O)c3c(Cl)cccc3Cl)ccc2N1.
What is the InChIKey of 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is RGRIACVTAQCZEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2NO2/c17-11-2-1-3-12(18)15(11)16(21)10-4-6-13-9(8-10)5-7-14(20)19-13/h1-4,6,8H,5,7H2,(H,19,20).
What are the key properties of 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one?
6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 320.18 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43160665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).