1,5-dimethylimidazo[4,5-c]pyridin-4-one

C8H9N3O — CID 14148531

IUPAC1,5-dimethylimidazo[4,5-c]pyridin-4-one
SMILESCn1ccc2c(ncn2C)c1=O
InChIInChI=1S/C8H9N3O/c1-10-4-3-6-7(8(10)12)9-5-11(6)2/h3-5H,1-2H3
InChIKeyMATOXYYPXVZHPM-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.27
Rot. Bonds

About 1,5-dimethylimidazo[4,5-c]pyridin-4-one

1,5-dimethylimidazo[4,5-c]pyridin-4-one (PubChem CID 14148531) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 1,5-dimethylimidazo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name1,5-dimethylimidazo[4,5-c]pyridin-4-one
PubChem CID14148531
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name1,5-dimethylimidazo[4,5-c]pyridin-4-one
SMILESCn1ccc2c(ncn2C)c1=O
InChIInChI=1S/C8H9N3O/c1-10-4-3-6-7(8(10)12)9-5-11(6)2/h3-5H,1-2H3
InChIKeyMATOXYYPXVZHPM-UHFFFAOYSA-N
XLogP0.27
TPSA39.82 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethylimidazo[4,5-c]pyridin-4-one?
The IUPAC name of 1,5-dimethylimidazo[4,5-c]pyridin-4-one (CID 14148531) is 1,5-dimethylimidazo[4,5-c]pyridin-4-one.
What is the SMILES notation for 1,5-dimethylimidazo[4,5-c]pyridin-4-one?
The canonical SMILES for 1,5-dimethylimidazo[4,5-c]pyridin-4-one is Cn1ccc2c(ncn2C)c1=O.
What is the InChIKey of 1,5-dimethylimidazo[4,5-c]pyridin-4-one?
The InChIKey is MATOXYYPXVZHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-10-4-3-6-7(8(10)12)9-5-11(6)2/h3-5H,1-2H3.
What are the key properties of 1,5-dimethylimidazo[4,5-c]pyridin-4-one?
1,5-dimethylimidazo[4,5-c]pyridin-4-one has a molecular weight of 163.18 g/mol, XLogP of 0.27, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethylimidazo[4,5-c]pyridin-4-one is sourced from PubChem (CID 14148531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).