3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one

C21H14N4O — CID 136740236

IUPAC3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one
SMILESO=c1[nH]c2ccccc2c2c1c(-c1ccccc1)nn2-c1ccccn1
InChIInChI=1S/C21H14N4O/c26-21-18-19(14-8-2-1-3-9-14)24-25(17-12-6-7-13-22-17)20(18)15-10-4-5-11-16(15)23-21/h1-13H,(H,23,26)
InChIKeyJRMCMXQQNDYIJV-UHFFFAOYSA-N
MW338.37 g/mol
LogP3.93
Rot. Bonds2

About 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one

3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one (PubChem CID 136740236) has the molecular formula C21H14N4O and a molecular weight of 338.37 g/mol. Its IUPAC name is 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one.

Molecular Properties

Compound Name3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one
PubChem CID136740236
Molecular FormulaC21H14N4O
Molecular Weight338.37 g/mol
Exact Mass338.12
IUPAC Name3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one
SMILESO=c1[nH]c2ccccc2c2c1c(-c1ccccc1)nn2-c1ccccn1
InChIInChI=1S/C21H14N4O/c26-21-18-19(14-8-2-1-3-9-14)24-25(17-12-6-7-13-22-17)20(18)15-10-4-5-11-16(15)23-21/h1-13H,(H,23,26)
InChIKeyJRMCMXQQNDYIJV-UHFFFAOYSA-N
XLogP3.93
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-oxo-1-pyridin-2-yl-9H-pyrazolo[5,4-b]quinoline-3-carboxylic acid
CID 135848103
3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one
CID 136740229
1,8,15-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-2,4,6,10,12,14,16-heptaen-9-one
CID 155808210
ethane;4-phenyl-1H-quinazolin-2-one
CID 159100188
6H-azepino[4,3-b]indol-1-one
CID 150838998
4-ethyl-3-phenyl-6H-pyridazino[4,3-c]quinolin-5-one
CID 91824336
9H-carbazole;2-phenylpyrimidine
CID 135341743
7,18-dipyridin-2-yl-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
CID 139067375
2-pyridin-2-yl-4-thiophen-2-ylphthalazin-1-one
CID 3965196
5-(2,6-dipyridin-2-yl-4-pyridinyl)-1,3,4-triphenylbenzo[g]indazole
CID 170441271
1-(2-phenyl-1H-indol-3-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 8548729
6-fluoro-3-methyl-1-pyridin-2-yl-9H-pyrazolo[5,4-b]quinolin-4-one
CID 135537136

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one?
The IUPAC name of 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one (CID 136740236) is 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one.
What is the SMILES notation for 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one?
The canonical SMILES for 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one is O=c1[nH]c2ccccc2c2c1c(-c1ccccc1)nn2-c1ccccn1.
What is the InChIKey of 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one?
The InChIKey is JRMCMXQQNDYIJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N4O/c26-21-18-19(14-8-2-1-3-9-14)24-25(17-12-6-7-13-22-17)20(18)15-10-4-5-11-16(15)23-21/h1-13H,(H,23,26).
What are the key properties of 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one?
3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one has a molecular weight of 338.37 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one is sourced from PubChem (CID 136740236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).