3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one

C26H19N5O2 — CID 139230868

IUPAC3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one
SMILESCOc1ccc2c(c1)[nH]c(=O)c1c(-c3cn(-c4ccccc4)nc3-c3ccccc3)n[nH]c12
InChIInChI=1S/C26H19N5O2/c1-33-18-12-13-19-21(14-18)27-26(32)22-24(19)28-29-25(22)20-15-31(17-10-6-3-7-11-17)30-23(20)16-8-4-2-5-9-16/h2-15H,1H3,(H,27,32)(H,28,29)
InChIKeyAIYLGNYGEYNAOT-UHFFFAOYSA-N
MW433.47 g/mol
LogP4.93
Rot. Bonds4

About 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one

3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one (PubChem CID 139230868) has the molecular formula C26H19N5O2 and a molecular weight of 433.47 g/mol. Its IUPAC name is 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one.

Molecular Properties

Compound Name3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one
PubChem CID139230868
Molecular FormulaC26H19N5O2
Molecular Weight433.47 g/mol
Exact Mass433.15
IUPAC Name3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one
SMILESCOc1ccc2c(c1)[nH]c(=O)c1c(-c3cn(-c4ccccc4)nc3-c3ccccc3)n[nH]c12
InChIInChI=1S/C26H19N5O2/c1-33-18-12-13-19-21(14-18)27-26(32)22-24(19)28-29-25(22)20-15-31(17-10-6-3-7-11-17)30-23(20)16-8-4-2-5-9-16/h2-15H,1H3,(H,27,32)(H,28,29)
InChIKeyAIYLGNYGEYNAOT-UHFFFAOYSA-N
XLogP4.93
TPSA88.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.47
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one with MolForge

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Related Compounds

PZ-II-029
CID 10426200
7-Methoxy-2-phenyl-2,5-dihydro-pyrazolo[4,3-c]quinolin-3-one
CID 10424361
2-(3-methoxyphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 10266271
9-methoxy-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 10469516
2-(3-methoxy-4-((methylamino)methyl)phenyl)-2H-indazole-7-carboxamide
CID 46226375
1-(1H-indol-3-yl)-2-((3-methoxyphenyl)amino)-2-(pyrazolo[1,5-a]pyridin-2-yl)ethanone
CID 86728689
[7-Methoxy-2-(4-methoxy-d3-phenyl)-2,5-dihydro-3h-pyrazolo-[4,3-c]quinolin-3-one]
CID 124111361
N-[3-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]oxy]phenyl]benzamide
CID 9910658
1,5-dimethyl-N-[3-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]oxy]phenyl]pyrazole-3-carboxamide
CID 22978008
(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methanone
CID 3465979
2-phenyl-7-phenylmethoxy-1H-pyrazolo[4,3-c]quinolin-3-one
CID 10474129
2-(3-methoxyphenyl)-2H-pyrazolo[3,4-c]quinolin-4(5H)-one
CID 44427579

Frequently Asked Questions

What is the IUPAC name of 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
The IUPAC name of 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one (CID 139230868) is 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one.
What is the SMILES notation for 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
The canonical SMILES for 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one is COc1ccc2c(c1)[nH]c(=O)c1c(-c3cn(-c4ccccc4)nc3-c3ccccc3)n[nH]c12.
What is the InChIKey of 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
The InChIKey is AIYLGNYGEYNAOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N5O2/c1-33-18-12-13-19-21(14-18)27-26(32)22-24(19)28-29-25(22)20-15-31(17-10-6-3-7-11-17)30-23(20)16-8-4-2-5-9-16/h2-15H,1H3,(H,27,32)(H,28,29).
What are the key properties of 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one has a molecular weight of 433.47 g/mol, XLogP of 4.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-diphenylpyrazol-4-yl)-7-methoxy-1,5-dihydropyrazolo[4,5-c]quinolin-4-one is sourced from PubChem (CID 139230868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).