6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one

C7H11N3O — CID 45083024

IUPAC6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one
SMILESCC1Cc2[nH]c(=O)[nH]c2CN1
InChIInChI=1S/C7H11N3O/c1-4-2-5-6(3-8-4)10-7(11)9-5/h4,8H,2-3H2,1H3,(H2,9,10,11)
InChIKeyIFJMXXGTKYMGTJ-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.26
Rot. Bonds

About 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one

6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one (PubChem CID 45083024) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one.

Molecular Properties

Compound Name6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one
PubChem CID45083024
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one
SMILESCC1Cc2[nH]c(=O)[nH]c2CN1
InChIInChI=1S/C7H11N3O/c1-4-2-5-6(3-8-4)10-7(11)9-5/h4,8H,2-3H2,1H3,(H2,9,10,11)
InChIKeyIFJMXXGTKYMGTJ-UHFFFAOYSA-N
XLogP-0.26
TPSA60.68 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one?
The IUPAC name of 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one (CID 45083024) is 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one.
What is the SMILES notation for 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one?
The canonical SMILES for 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one is CC1Cc2[nH]c(=O)[nH]c2CN1.
What is the InChIKey of 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one?
The InChIKey is IFJMXXGTKYMGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-4-2-5-6(3-8-4)10-7(11)9-5/h4,8H,2-3H2,1H3,(H2,9,10,11).
What are the key properties of 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one?
6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one has a molecular weight of 153.19 g/mol, XLogP of -0.26, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one is sourced from PubChem (CID 45083024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).