3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one

C11H12N4O2 — CID 96599118

IUPAC3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one
SMILESCc1cnc(-n2nc3c(c2C)C(=O)CNC3)o1
InChIInChI=1S/C11H12N4O2/c1-6-3-13-11(17-6)15-7(2)10-8(14-15)4-12-5-9(10)16/h3,12H,4-5H2,1-2H3
InChIKeyDQHGPLAWSNTRMK-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.76
Rot. Bonds1

About 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one

3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one (PubChem CID 96599118) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one.

Molecular Properties

Compound Name3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one
PubChem CID96599118
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one
SMILESCc1cnc(-n2nc3c(c2C)C(=O)CNC3)o1
InChIInChI=1S/C11H12N4O2/c1-6-3-13-11(17-6)15-7(2)10-8(14-15)4-12-5-9(10)16/h3,12H,4-5H2,1-2H3
InChIKeyDQHGPLAWSNTRMK-UHFFFAOYSA-N
XLogP0.76
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one with MolForge

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one?
The IUPAC name of 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one (CID 96599118) is 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one.
What is the SMILES notation for 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one?
The canonical SMILES for 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one is Cc1cnc(-n2nc3c(c2C)C(=O)CNC3)o1.
What is the InChIKey of 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one?
The InChIKey is DQHGPLAWSNTRMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-6-3-13-11(17-6)15-7(2)10-8(14-15)4-12-5-9(10)16/h3,12H,4-5H2,1-2H3.
What are the key properties of 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one?
3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one has a molecular weight of 232.24 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(5-methyl-1,3-oxazol-2-yl)-6,7-dihydro-5H-pyrazolo[3,4-c]pyridin-4-one is sourced from PubChem (CID 96599118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).