1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one

C8H9N3O — CID 136762358

IUPAC1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one
SMILESCc1cc2c(cnn2C)c(=O)[nH]1
InChIInChI=1S/C8H9N3O/c1-5-3-7-6(8(12)10-5)4-9-11(7)2/h3-4H,1-2H3,(H,10,12)
InChIKeyWRXANLITJMZZDE-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.57
Rot. Bonds

About 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one

1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one (PubChem CID 136762358) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one
PubChem CID136762358
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one
SMILESCc1cc2c(cnn2C)c(=O)[nH]1
InChIInChI=1S/C8H9N3O/c1-5-3-7-6(8(12)10-5)4-9-11(7)2/h3-4H,1-2H3,(H,10,12)
InChIKeyWRXANLITJMZZDE-UHFFFAOYSA-N
XLogP0.57
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyano-3-(1,3-dimethyl-1H-pyrazol-4-yl)acrylamide
CID 840773
3-amino-1,6-dimethyl-5H-pyrazolo[4,3-c]pyridin-4-one
CID 136025888
6-Methyl-1h-pyrazolo[4,3-c]pyridin-4(5h)-one
CID 136025892
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-5-methyl-1-propan-2-ylpyrazole-4-carboxamide
CID 168272756
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,5-dimethylpyrazole-4-carboxamide
CID 41416719
5-methyl-N-[3-(6-methyl-2-oxo-1(2H)-pyridinyl)propyl]-1-propyl-1H-pyrazole-4-carboxamide
CID 72907527
N-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-1-(2,2,2-trifluoroethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 89018336
3-fluoro-2,6-dimethyl-5H-pyrazolo[4,3-c]pyridin-4-one
CID 137095947
3-(difluoromethyl)-N-(2,3-dihydro-1H-azepin-5-yl)-1-methylpyrazole-4-carboxamide
CID 143664094
3-(difluoromethyl)-N-(1-ethyl-6-oxo-3-pyridinyl)-1-methylpyrazole-4-carboxamide
CID 146323223
N-(1-ethyl-6-oxo-3-pyridinyl)-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 146323226
1-[(E)-2-(aminomethyl)-3-fluoroprop-2-enyl]-5-ethylpyrazolo[4,5-c]pyridin-4-one
CID 154637353

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one?
The IUPAC name of 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one (CID 136762358) is 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one.
What is the SMILES notation for 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one?
The canonical SMILES for 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one is Cc1cc2c(cnn2C)c(=O)[nH]1.
What is the InChIKey of 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one?
The InChIKey is WRXANLITJMZZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-5-3-7-6(8(12)10-5)4-9-11(7)2/h3-4H,1-2H3,(H,10,12).
What are the key properties of 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one?
1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one has a molecular weight of 163.18 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-5H-pyrazolo[4,5-c]pyridin-4-one is sourced from PubChem (CID 136762358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).