2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one

C23H18N4O — CID 2785493

IUPAC2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one
SMILESCc1c2c(=O)n(-c3ccccc3)c3ccccc3c2nn1Nc1ccccc1
InChIInChI=1S/C23H18N4O/c1-16-21-22(25-27(16)24-17-10-4-2-5-11-17)19-14-8-9-15-20(19)26(23(21)28)18-12-6-3-7-13-18/h2-15,24H,1H3
InChIKeyPDEKCCZYWBGUSZ-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.52
Rot. Bonds3

About 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one

2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one (PubChem CID 2785493) has the molecular formula C23H18N4O and a molecular weight of 366.42 g/mol. Its IUPAC name is 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one
PubChem CID2785493
Molecular FormulaC23H18N4O
Molecular Weight366.42 g/mol
Exact Mass366.15
IUPAC Name2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one
SMILESCc1c2c(=O)n(-c3ccccc3)c3ccccc3c2nn1Nc1ccccc1
InChIInChI=1S/C23H18N4O/c1-16-21-22(25-27(16)24-17-10-4-2-5-11-17)19-14-8-9-15-20(19)26(23(21)28)18-12-6-3-7-13-18/h2-15,24H,1H3
InChIKeyPDEKCCZYWBGUSZ-UHFFFAOYSA-N
XLogP4.52
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-5-phenyl-1H-pyrazolo[4,5-c]quinolin-4-one
CID 131848680
3-butyl-4-chloro-1-phenylquinolin-2-one
CID 139216420
4,12-diphenyl-16-triphenylen-2-yl-4,12,16-triazahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),5,7,9,14,17,19,21,23-decaen-3-one
CID 164807131
4-(2-oxo-1-phenylquinolin-4-yl)-1-phenylquinolin-2-one
CID 11503080
3-ethyl-4-(methylamino)-1-phenylquinolin-2-one
CID 123908561
3,4-dimethyl-2-phenylisoquinolin-1-one;ethane
CID 165126064
3-ethyl-4-hydroxy-1-phenylquinolin-2-one
CID 54677985
2,4-diphenyl-7-(9-phenylcarbazol-3-yl)pyrimido[4,5-c]carbazole-1,3-dione
CID 122491563
8-amino-3-methyl-1-oxo-2-phenylisoquinoline-4-carboxylic acid
CID 67493384
4-hydroxy-3-[5-(4-hydroxy-2-oxo-1-phenylquinolin-3-yl)pentyl]-1-phenylquinolin-2-one
CID 110273136
4-hydroxy-3-(4-hydroxy-2-oxo-1-phenylquinolin-3-yl)sulfanyl-1-phenylquinolin-2-one
CID 102581403
2-methyl-3-phenylpyrrolo[2,1-f][1,2,4]triazin-4-one
CID 90102357

Frequently Asked Questions

What is the IUPAC name of 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one (CID 2785493) is 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one is Cc1c2c(=O)n(-c3ccccc3)c3ccccc3c2nn1Nc1ccccc1.
What is the InChIKey of 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one?
The InChIKey is PDEKCCZYWBGUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O/c1-16-21-22(25-27(16)24-17-10-4-2-5-11-17)19-14-8-9-15-20(19)26(23(21)28)18-12-6-3-7-13-18/h2-15,24H,1H3.
What are the key properties of 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one?
2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one has a molecular weight of 366.42 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-3-methyl-5-phenylpyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 2785493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).