3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one

C7H9N3O — CID 572770

IUPAC3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one
SMILESCc1[nH]nc2c1CC(=O)NC2
InChIInChI=1S/C7H9N3O/c1-4-5-2-7(11)8-3-6(5)10-9-4/h2-3H2,1H3,(H,8,11)(H,9,10)
InChIKeySLLVQBZYOMPPFC-UHFFFAOYSA-N
MW151.17 g/mol
LogP-0.11
Rot. Bonds

About 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one

3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one (PubChem CID 572770) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one.

Molecular Properties

Compound Name3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one
PubChem CID572770
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one
SMILESCc1[nH]nc2c1CC(=O)NC2
InChIInChI=1S/C7H9N3O/c1-4-5-2-7(11)8-3-6(5)10-9-4/h2-3H2,1H3,(H,8,11)(H,9,10)
InChIKeySLLVQBZYOMPPFC-UHFFFAOYSA-N
XLogP-0.11
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one?
The IUPAC name of 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one (CID 572770) is 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one.
What is the SMILES notation for 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one?
The canonical SMILES for 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one is Cc1[nH]nc2c1CC(=O)NC2.
What is the InChIKey of 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one?
The InChIKey is SLLVQBZYOMPPFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-4-5-2-7(11)8-3-6(5)10-9-4/h2-3H2,1H3,(H,8,11)(H,9,10).
What are the key properties of 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one?
3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one has a molecular weight of 151.17 g/mol, XLogP of -0.11, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2,4,6,7-tetrahydropyrazolo[3,4-c]pyridin-5-one is sourced from PubChem (CID 572770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).