2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one

C23H16N2O — CID 102532246

IUPAC2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one
SMILESO=C1c2c(c(-c3ccccc3)nc3ccccc23)CN1c1ccccc1
InChIInChI=1S/C23H16N2O/c26-23-21-18-13-7-8-14-20(18)24-22(16-9-3-1-4-10-16)19(21)15-25(23)17-11-5-2-6-12-17/h1-14H,15H2
InChIKeyBBHKGFOSQZQLTL-UHFFFAOYSA-N
MW336.39 g/mol
LogP5.06
Rot. Bonds2

About 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one

2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one (PubChem CID 102532246) has the molecular formula C23H16N2O and a molecular weight of 336.39 g/mol. Its IUPAC name is 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one.

Molecular Properties

Compound Name2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one
PubChem CID102532246
Molecular FormulaC23H16N2O
Molecular Weight336.39 g/mol
Exact Mass336.13
IUPAC Name2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one
SMILESO=C1c2c(c(-c3ccccc3)nc3ccccc23)CN1c1ccccc1
InChIInChI=1S/C23H16N2O/c26-23-21-18-13-7-8-14-20(18)24-22(16-9-3-1-4-10-16)19(21)15-25(23)17-11-5-2-6-12-17/h1-14H,15H2
InChIKeyBBHKGFOSQZQLTL-UHFFFAOYSA-N
XLogP5.06
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.39
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-4-phenyl-3H-pyrrolo[3,4-c]quinolin-1-one
CID 102532244
9-methyl-2-phenyl-3H-pyrrolo[3,4-b]quinolin-1-one
CID 72710503
5,11-diphenyl-1,5,8,12-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),8,10-triene-2,6-dione
CID 14867542
3-chloro-2,4-diphenylquinoline
CID 10781654
4-phenyl-4,10-diazatricyclo[5.2.1.02,6]deca-1,6,8-trien-3-one
CID 154447499
3-amino-2-phenylquinoline-4-carboxamide
CID 140977990
4-(4-ethyl-1-phenyl-4,5-dihydroimidazol-2-yl)-3-methoxy-2-phenylquinoline
CID 70163885
8-methyl-2,4-diphenylpyrrolo[3,4-c]quinoline-1,3-dione
CID 71819080
4-[3-(hydroxymethyl)phenyl]-6-morpholin-4-yl-2-phenyl-3H-pyrrolo[3,4-c]pyridin-1-one
CID 134806764
5,8-dimethyl-6,7-dihydroquinolino[3,2-c]acridine;5,8-diphenyl-6,7-dihydroquinolino[3,2-c]acridine
CID 158548153
2-phenylquinoline-3,4-dicarboxylic acid
CID 71341092
3-hydroxy-1-phenyl-4-(4-phenylphenyl)-2H-pyrrol-5-one
CID 67834371

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one?
The IUPAC name of 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one (CID 102532246) is 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one.
What is the SMILES notation for 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one?
The canonical SMILES for 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one is O=C1c2c(c(-c3ccccc3)nc3ccccc23)CN1c1ccccc1.
What is the InChIKey of 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one?
The InChIKey is BBHKGFOSQZQLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O/c26-23-21-18-13-7-8-14-20(18)24-22(16-9-3-1-4-10-16)19(21)15-25(23)17-11-5-2-6-12-17/h1-14H,15H2.
What are the key properties of 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one?
2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one has a molecular weight of 336.39 g/mol, XLogP of 5.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-3H-pyrrolo[3,4-c]quinolin-1-one is sourced from PubChem (CID 102532246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).