3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one

C9H10N2O — CID 90167656

IUPAC3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one
SMILESCc1c[nH]c2cn(C)c(=O)cc12
InChIInChI=1S/C9H10N2O/c1-6-4-10-8-5-11(2)9(12)3-7(6)8/h3-5,10H,1-2H3
InChIKeyXMEUVUVBTBFISB-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.18
Rot. Bonds

About 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one

3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one (PubChem CID 90167656) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one.

Molecular Properties

Compound Name3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one
PubChem CID90167656
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one
SMILESCc1c[nH]c2cn(C)c(=O)cc12
InChIInChI=1S/C9H10N2O/c1-6-4-10-8-5-11(2)9(12)3-7(6)8/h3-5,10H,1-2H3
InChIKeyXMEUVUVBTBFISB-UHFFFAOYSA-N
XLogP1.18
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one with MolForge

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

Launch Full Analysis

Related Compounds

6-hydroxy-N-methylmyosmine
CID 52944012
6-hydroxy-N-methylmyosmine(1+)
CID 91820593
4-Amino-5-methylpyridin-2(1H)-one
CID 13295732
6-methyl-1H,2H,3H,5H,6H-pyrrolo[2,3-c]pyridin-5-one
CID 71758441
1,2,3,5-Tetrahydro-6H-pyrrolo(3,2-c)pyridin-6-one
CID 12863119
5-[2-(dimethylamino)ethyl]-3-fluoro-1H-pyridin-2-one
CID 172281521
1-Acetyl-1,2,3,5-tetrahydro-6H-pyrrolo[3,2-c]pyridin-6-one
CID 3645068
6H-Pyrrolo[3,4-C]pyridin-6-one, 1,2,3,5-tetrahydro-2-methyl-
CID 45079775
1-Formyl-6-oxo-5-azaindoline
CID 12926932
5-(4,5-Dihydro-1H-pyrrol-2-yl)-2(1H)-pyridinone
CID 129851173
Methanidyl-[(1-methyl-2-oxo-4-pyridinyl)methyl]azanium
CID 21030020
3,6-Dihydropyrrolo[3,2-f]quinolin-2-one
CID 21907020

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one?
The IUPAC name of 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one (CID 90167656) is 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one.
What is the SMILES notation for 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one?
The canonical SMILES for 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one is Cc1c[nH]c2cn(C)c(=O)cc12.
What is the InChIKey of 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one?
The InChIKey is XMEUVUVBTBFISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-6-4-10-8-5-11(2)9(12)3-7(6)8/h3-5,10H,1-2H3.
What are the key properties of 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one?
3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one has a molecular weight of 162.19 g/mol, XLogP of 1.18, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-1H-pyrrolo[2,3-c]pyridin-5-one is sourced from PubChem (CID 90167656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).