3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one

C9H9BrN2O — CID 155803961

IUPAC3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one
SMILESCc1cc2c(Br)cn(C)c2c(=O)[nH]1
InChIInChI=1S/C9H9BrN2O/c1-5-3-6-7(10)4-12(2)8(6)9(13)11-5/h3-4H,1-2H3,(H,11,13)
InChIKeyUCTUZZFWASJDSE-UHFFFAOYSA-N
MW241.09 g/mol
LogP1.94
Rot. Bonds

About 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one

3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one (PubChem CID 155803961) has the molecular formula C9H9BrN2O and a molecular weight of 241.09 g/mol. Its IUPAC name is 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one
PubChem CID155803961
Molecular FormulaC9H9BrN2O
Molecular Weight241.09 g/mol
Exact Mass239.99
IUPAC Name3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one
SMILESCc1cc2c(Br)cn(C)c2c(=O)[nH]1
InChIInChI=1S/C9H9BrN2O/c1-5-3-6-7(10)4-12(2)8(6)9(13)11-5/h3-4H,1-2H3,(H,11,13)
InChIKeyUCTUZZFWASJDSE-UHFFFAOYSA-N
XLogP1.94
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.09
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-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

1,4,5-trimethyl-6H-pyrrolo[2,3-c]pyridin-7-one
CID 90213415
4-bromo-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
CID 90351143
7-bromo-2,5-dimethylthieno[3,2-c]pyridin-4-one
CID 144628500
1-(2-bromoethyl)-5-methyl-6H-pyrrolo[2,3-c]pyridin-7-one
CID 102942268
3,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-2-one
CID 118005067
3-bromo-5,6-dimethyl-1H-pyridin-2-one
CID 50944339
(4-bromo-2-formyl-6-methyl-7-oxopyrrolo[2,3-c]pyridin-1-yl) thiohypoiodite
CID 176938584
4-bromo-6-fluoro-2-methylisoquinolin-1-one
CID 118021521
4-bromo-7-chloro-2-methylisoquinolin-1-one
CID 133054078
1-(2-chloroethyl)-5-methyl-6H-pyrrolo[2,3-c]pyridin-7-one
CID 102942271
5-bromo-3-methoxy-1,2-dimethylpyridin-4-one
CID 12511612
3-bromo-7-fluoro-1-methylindole
CID 154562151

Frequently Asked Questions

What is the IUPAC name of 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one?
The IUPAC name of 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one (CID 155803961) is 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one.
What is the SMILES notation for 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one?
The canonical SMILES for 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one is Cc1cc2c(Br)cn(C)c2c(=O)[nH]1.
What is the InChIKey of 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one?
The InChIKey is UCTUZZFWASJDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN2O/c1-5-3-6-7(10)4-12(2)8(6)9(13)11-5/h3-4H,1-2H3,(H,11,13).
What are the key properties of 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one?
3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one has a molecular weight of 241.09 g/mol, XLogP of 1.94, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-1,5-dimethyl-6H-pyrrolo[2,3-c]pyridin-7-one is sourced from PubChem (CID 155803961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).