4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile

C24H15N3O — CID 11371867

IUPAC4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile
SMILESN#Cc1ccc(-c2ccc3c(c2)C(c2ccc4ccccc4n2)C(=O)N3)cc1
InChIInChI=1S/C24H15N3O/c25-14-15-5-7-16(8-6-15)18-10-11-21-19(13-18)23(24(28)27-21)22-12-9-17-3-1-2-4-20(17)26-22/h1-13,23H,(H,27,28)
InChIKeyQRTWABXAQXFPTE-UHFFFAOYSA-N
MW361.40 g/mol
LogP4.86
Rot. Bonds2

About 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile

4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile (PubChem CID 11371867) has the molecular formula C24H15N3O and a molecular weight of 361.40 g/mol. Its IUPAC name is 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile.

Molecular Properties

Compound Name4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile
PubChem CID11371867
Molecular FormulaC24H15N3O
Molecular Weight361.40 g/mol
Exact Mass361.12
IUPAC Name4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile
SMILESN#Cc1ccc(-c2ccc3c(c2)C(c2ccc4ccccc4n2)C(=O)N3)cc1
InChIInChI=1S/C24H15N3O/c25-14-15-5-7-16(8-6-15)18-10-11-21-19(13-18)23(24(28)27-21)22-12-9-17-3-1-2-4-20(17)26-22/h1-13,23H,(H,27,28)
InChIKeyQRTWABXAQXFPTE-UHFFFAOYSA-N
XLogP4.86
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-pyridin-4-yl-3-quinolin-2-yl-1,3-dihydroindol-2-one
CID 11325197
5-(3-aminophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one
CID 11382554
5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one
CID 11210420
3-quinolin-2-yl-1,3-dihydroindol-2-one
CID 58723455
6-(3-aminophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one
CID 11291078
3-(6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-2-yl)-2-oxo-1,3-dihydroindole-5-carbonitrile
CID 56948376
N'-[3-(dimethylamino)propyl]-2-oxo-3-quinolin-2-yl-1,3-dihydroindole-5-carboximidamide
CID 11372625
tert-butyl 2-(5-cyano-2-oxo-1,3-dihydroindol-3-yl)-7,8-dihydro-5H-1,6-naphthyridine-6-carboxylate
CID 66823325
4-[4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-2-yl]phenyl]benzonitrile
CID 134317916
ethane;2-quinolin-2-ylindene-1,3-dione
CID 123277831
2-[11-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-4,6-diphenyl-1,3,5-triazine;4-[6-[4-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]phenyl]-2-phenylpyrimidin-4-yl]benzonitrile;2-[11-[4-(6-naphthalen-1-yl-2-phenylpyrimidin-4-yl)phenyl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-4,6-diphenyl-1,3,5-triazine
CID 167630245
4-[5-([1,2,4]triazolo[1,5-c]quinazolin-2-yl)-1H-pyrazol-3-yl]benzonitrile
CID 136575678

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile?
The IUPAC name of 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile (CID 11371867) is 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile.
What is the SMILES notation for 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile?
The canonical SMILES for 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile is N#Cc1ccc(-c2ccc3c(c2)C(c2ccc4ccccc4n2)C(=O)N3)cc1.
What is the InChIKey of 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile?
The InChIKey is QRTWABXAQXFPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15N3O/c25-14-15-5-7-16(8-6-15)18-10-11-21-19(13-18)23(24(28)27-21)22-12-9-17-3-1-2-4-20(17)26-22/h1-13,23H,(H,27,28).
What are the key properties of 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile?
4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile has a molecular weight of 361.40 g/mol, XLogP of 4.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxo-3-quinolin-2-yl-1,3-dihydroindol-5-yl)benzonitrile is sourced from PubChem (CID 11371867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).