2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine

C16H15N3 — CID 81137449

IUPAC2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccc2[nH]c(-c3ccc4c(c3)CCC4)nc2n1
InChIInChI=1S/C16H15N3/c1-10-5-8-14-16(17-10)19-15(18-14)13-7-6-11-3-2-4-12(11)9-13/h5-9H,2-4H2,1H3,(H,17,18,19)
InChIKeyXQMQQPVUGDICDV-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.42
Rot. Bonds1

About 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine

2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 81137449) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID81137449
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccc2[nH]c(-c3ccc4c(c3)CCC4)nc2n1
InChIInChI=1S/C16H15N3/c1-10-5-8-14-16(17-10)19-15(18-14)13-7-6-11-3-2-4-12(11)9-13/h5-9H,2-4H2,1H3,(H,17,18,19)
InChIKeyXQMQQPVUGDICDV-UHFFFAOYSA-N
XLogP3.42
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine 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 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine (CID 81137449) is 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine is Cc1ccc2[nH]c(-c3ccc4c(c3)CCC4)nc2n1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is XQMQQPVUGDICDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-10-5-8-14-16(17-10)19-15(18-14)13-7-6-11-3-2-4-12(11)9-13/h5-9H,2-4H2,1H3,(H,17,18,19).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine?
2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 249.32 g/mol, XLogP of 3.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 81137449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).