7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one

C17H11ClN2O — CID 138961466

IUPAC7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one
SMILESO=c1cc(-c2c[nH]c3ccccc23)c2ccc(Cl)cc2[nH]1
InChIInChI=1S/C17H11ClN2O/c18-10-5-6-12-13(8-17(21)20-16(12)7-10)14-9-19-15-4-2-1-3-11(14)15/h1-9,19H,(H,20,21)
InChIKeyBQOVLQXDSDVCFL-UHFFFAOYSA-N
MW294.74 g/mol
LogP4.33
Rot. Bonds1

About 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one

7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one (PubChem CID 138961466) has the molecular formula C17H11ClN2O and a molecular weight of 294.74 g/mol. Its IUPAC name is 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one
PubChem CID138961466
Molecular FormulaC17H11ClN2O
Molecular Weight294.74 g/mol
Exact Mass294.06
IUPAC Name7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one
SMILESO=c1cc(-c2c[nH]c3ccccc23)c2ccc(Cl)cc2[nH]1
InChIInChI=1S/C17H11ClN2O/c18-10-5-6-12-13(8-17(21)20-16(12)7-10)14-9-19-15-4-2-1-3-11(14)15/h1-9,19H,(H,20,21)
InChIKeyBQOVLQXDSDVCFL-UHFFFAOYSA-N
XLogP4.33
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.74
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

5,7-dichloro-3-(1H-indol-3-yl)-1H-indole
CID 10518361
3-chloro-5,7-dihydroindolo[2,3-c]quinolin-6-one
CID 71560083
3-(5-chloro-1H-indol-3-yl)-1H-quinoxalin-2-one
CID 137302524
4-(3,4-dichlorophenyl)-1H-quinolin-2-one
CID 18987231
6-chloro-2-(6-chloro-1H-indol-3-yl)-1H-indole
CID 177408697
3-[4-(1H-indol-3-yl)phenyl]-1H-indole
CID 175007681
2-(1H-indol-3-yl)thiochromen-4-one
CID 54116167
4-(1H-indol-3-yl)cyclohexa-3,5-diene-1,2-dione
CID 134923817
4,7-dichloro-2-(6-chloro-1H-indol-3-yl)quinoline
CID 18729655
2-(1H-indol-3-yl)aniline
CID 25210227
6-(1H-indol-3-yl)-1H-pyrimidin-2-one
CID 116900685
5-chloro-2-(1H-indol-3-ylmethylidene)-1-benzothiophen-3-one
CID 67028094

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one?
The IUPAC name of 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one (CID 138961466) is 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one.
What is the SMILES notation for 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one?
The canonical SMILES for 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one is O=c1cc(-c2c[nH]c3ccccc23)c2ccc(Cl)cc2[nH]1.
What is the InChIKey of 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one?
The InChIKey is BQOVLQXDSDVCFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN2O/c18-10-5-6-12-13(8-17(21)20-16(12)7-10)14-9-19-15-4-2-1-3-11(14)15/h1-9,19H,(H,20,21).
What are the key properties of 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one?
7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one has a molecular weight of 294.74 g/mol, XLogP of 4.33, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one is sourced from PubChem (CID 138961466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).