1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one

C14H13N3O — CID 135418904

IUPAC1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCc1cc(=O)[nH]c2c1c(-c1ccccc1)nn2C
InChIInChI=1S/C14H13N3O/c1-9-8-11(18)15-14-12(9)13(16-17(14)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,15,18)
InChIKeyCKPRIGVIXZWNSN-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.24
Rot. Bonds1

About 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one

1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one (PubChem CID 135418904) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one
PubChem CID135418904
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCc1cc(=O)[nH]c2c1c(-c1ccccc1)nn2C
InChIInChI=1S/C14H13N3O/c1-9-8-11(18)15-14-12(9)13(16-17(14)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,15,18)
InChIKeyCKPRIGVIXZWNSN-UHFFFAOYSA-N
XLogP2.24
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Zolazepam
CID 35775
6-methyl-2-(3-methyl-5-((4-methylphenyl)amino)-1H-pyrazol-1-yl)-1,4-dihydropyrimidin-4-one
CID 135415440
N-(1-methyl-3-phenylpyrazol-5-yl)benzamide
CID 2814962
2-Methyl-7-phenylpyrazolo[1,5-a]pyrimidin-5-ol
CID 135459218
N-(3,5-dimethylphenyl)-N'-(1-methyl-3-phenyl-1H-pyrazol-5-yl)urea
CID 2815275
1-Phenyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-6-ol
CID 135491988
1,3,4-trimethyl-1H,6H,7H-pyrazolo(3,4-b)pyridin-6-one
CID 135447117
5-Methyl-3-phenyl-11-thia-4,5,7-triazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),3-trien-8-one
CID 135875693
5-Methyl-3-phenyl-4,5,7-triazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),3-trien-8-one
CID 135875697
4-(Trifluoromethyl)-3-[3-(Trifluoromethyl)phenyl]-1,7-Dihydro-6h-Pyrazolo[3,4-B]pyridin-6-One
CID 135566520
3-Methyl-5-phenyl-4,5,7-triazatricyclo[7.4.0.0^{2,6}]trideca-1(9),2(6),3-trien-8-one
CID 135875704
3-Methyl-4-phenyl-2,7-dihydropyrazolo[3,4-b]pyridin-6-one
CID 141335958

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one (CID 135418904) is 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one is Cc1cc(=O)[nH]c2c1c(-c1ccccc1)nn2C.
What is the InChIKey of 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one?
The InChIKey is CKPRIGVIXZWNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-9-8-11(18)15-14-12(9)13(16-17(14)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,15,18).
What are the key properties of 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one?
1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one has a molecular weight of 239.28 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-3-phenyl-7H-pyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 135418904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).