3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one

C19H15ClN2O2 — CID 167947111

IUPAC3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one
SMILESO=C(Cc1cc2ccccc2[nH]c1=O)N1CCc2cc(Cl)ccc21
InChIInChI=1S/C19H15ClN2O2/c20-15-5-6-17-13(10-15)7-8-22(17)18(23)11-14-9-12-3-1-2-4-16(12)21-19(14)24/h1-6,9-10H,7-8,11H2,(H,21,24)
InChIKeyBEYFQKSTGNJRNM-UHFFFAOYSA-N
MW338.79 g/mol
LogP3.31
Rot. Bonds2

About 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one

3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one (PubChem CID 167947111) has the molecular formula C19H15ClN2O2 and a molecular weight of 338.79 g/mol. Its IUPAC name is 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one
PubChem CID167947111
Molecular FormulaC19H15ClN2O2
Molecular Weight338.79 g/mol
Exact Mass338.08
IUPAC Name3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one
SMILESO=C(Cc1cc2ccccc2[nH]c1=O)N1CCc2cc(Cl)ccc21
InChIInChI=1S/C19H15ClN2O2/c20-15-5-6-17-13(10-15)7-8-22(17)18(23)11-14-9-12-3-1-2-4-16(12)21-19(14)24/h1-6,9-10H,7-8,11H2,(H,21,24)
InChIKeyBEYFQKSTGNJRNM-UHFFFAOYSA-N
XLogP3.31
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.79
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one
CID 110355057
3-[[(1-acetyl-2,3-dihydroindol-5-yl)amino]methyl]-1H-quinolin-2-one
CID 86812574
1-acetyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 110324349
2-(6-chloro-1H-indol-3-yl)-1-(2,3-dihydroindol-1-yl)ethanone
CID 113209785
5-chloro-2,3-dihydroindole-1-carboxylic acid
CID 68859490
(2R)-1-[2-(2-oxo-1H-quinolin-3-yl)acetyl]pyrrolidine-2-carboxylic acid
CID 119372066
2-[1-[2-(2-oxo-1H-quinolin-3-yl)acetyl]piperidin-4-yl]acetamide
CID 56815967
(3S)-2-[2-(2-oxo-1H-quinolin-3-yl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CID 125151333
3-[2-[(3S)-3-aminopiperidin-1-yl]-2-oxoethyl]-1H-quinolin-2-one
CID 124628242
3-[2-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one
CID 95584393
3-[2-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-2-oxoethyl]-1H-quinolin-2-one
CID 56817964
3-[1-[2-(2-oxo-1H-quinolin-3-yl)acetyl]piperidin-2-yl]propanoic acid
CID 126790396

Frequently Asked Questions

What is the IUPAC name of 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one?
The IUPAC name of 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one (CID 167947111) is 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one.
What is the SMILES notation for 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one?
The canonical SMILES for 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one is O=C(Cc1cc2ccccc2[nH]c1=O)N1CCc2cc(Cl)ccc21.
What is the InChIKey of 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one?
The InChIKey is BEYFQKSTGNJRNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O2/c20-15-5-6-17-13(10-15)7-8-22(17)18(23)11-14-9-12-3-1-2-4-16(12)21-19(14)24/h1-6,9-10H,7-8,11H2,(H,21,24).
What are the key properties of 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one?
3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one has a molecular weight of 338.79 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one is sourced from PubChem (CID 167947111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).