5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one

C15H12N4O — CID 170286019

IUPAC5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one
SMILESCN1Cc2cc(-c3ccc4[nH]cnc4n3)ccc2C1=O
InChIInChI=1S/C15H12N4O/c1-19-7-10-6-9(2-3-11(10)15(19)20)12-4-5-13-14(18-12)17-8-16-13/h2-6,8H,7H2,1H3,(H,16,17,18)
InChIKeyLSODXFILBBFORK-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.21
Rot. Bonds1

About 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one

5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one (PubChem CID 170286019) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one.

Molecular Properties

Compound Name5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one
PubChem CID170286019
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one
SMILESCN1Cc2cc(-c3ccc4[nH]cnc4n3)ccc2C1=O
InChIInChI=1S/C15H12N4O/c1-19-7-10-6-9(2-3-11(10)15(19)20)12-4-5-13-14(18-12)17-8-16-13/h2-6,8H,7H2,1H3,(H,16,17,18)
InChIKeyLSODXFILBBFORK-UHFFFAOYSA-N
XLogP2.21
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-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

5-(2-ethyl-1H-imidazo[4,5-b]pyridin-6-yl)-2-methyl-3H-isoindol-1-one
CID 157017391
2-methyl-5-(4-methylphenyl)-3H-isoindol-1-one
CID 123197449
2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-3H-isoindol-1-one
CID 155909232
5-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-methyl-3H-isoindol-1-one
CID 155777191
5-[6-(5-amino-3-pyridinyl)-3-pyridinyl]-2-methyl-3H-isoindol-1-one
CID 90042635
5-[3-(dimethylamino)phenyl]-2-methyl-3H-isoindol-1-one
CID 155495141
2,5-dimethylisoindole-1,3-dione;2,5-dimethyl-3H-isoindol-1-one
CID 142859605
methyl-[6-(2-methyl-1-oxo-3H-isoindol-5-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]carbamic acid
CID 67502210
5-(2-amino-5-chloro-6-methylpyrimidin-4-yl)-2-methyl-3H-isoindol-1-one
CID 155911428
5-[4-(2-aminoethyl)phenyl]-2-methyl-3H-isoindol-1-one
CID 157017376
5-(2-methyl-1-oxo-3H-isoindol-5-yl)thiophene-2-carbaldehyde
CID 72793095
5-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-6-yl)-2-methyl-3H-isoindol-1-one
CID 155916412

Frequently Asked Questions

What is the IUPAC name of 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one?
The IUPAC name of 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one (CID 170286019) is 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one.
What is the SMILES notation for 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one?
The canonical SMILES for 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one is CN1Cc2cc(-c3ccc4[nH]cnc4n3)ccc2C1=O.
What is the InChIKey of 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one?
The InChIKey is LSODXFILBBFORK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c1-19-7-10-6-9(2-3-11(10)15(19)20)12-4-5-13-14(18-12)17-8-16-13/h2-6,8H,7H2,1H3,(H,16,17,18).
What are the key properties of 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one?
5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one has a molecular weight of 264.29 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-imidazo[4,5-b]pyridin-5-yl)-2-methyl-3H-isoindol-1-one is sourced from PubChem (CID 170286019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).