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

C16H16N4 — CID 79817017

IUPAC2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCNc1ccc2[nH]c(-c3ccc4c(c3)CCC4)nc2n1
InChIInChI=1S/C16H16N4/c1-17-14-8-7-13-16(19-14)20-15(18-13)12-6-5-10-3-2-4-11(10)9-12/h5-9H,2-4H2,1H3,(H2,17,18,19,20)
InChIKeyYNFRMZQDDUYVSQ-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.16
Rot. Bonds2

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

2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79817017) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79817017
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCNc1ccc2[nH]c(-c3ccc4c(c3)CCC4)nc2n1
InChIInChI=1S/C16H16N4/c1-17-14-8-7-13-16(19-14)20-15(18-13)12-6-5-10-3-2-4-11(10)9-12/h5-9H,2-4H2,1H3,(H2,17,18,19,20)
InChIKeyYNFRMZQDDUYVSQ-UHFFFAOYSA-N
XLogP3.16
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine 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)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine (CID 79817017) is 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine is CNc1ccc2[nH]c(-c3ccc4c(c3)CCC4)nc2n1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is YNFRMZQDDUYVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-17-14-8-7-13-16(19-14)20-15(18-13)12-6-5-10-3-2-4-11(10)9-12/h5-9H,2-4H2,1H3,(H2,17,18,19,20).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 264.33 g/mol, XLogP of 3.16, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79817017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).