2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine

C16H18N4 — CID 79821611

IUPAC2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCc1ccc(-c2nc3nc(N(C)C)ccc3[nH]2)cc1
InChIInChI=1S/C16H18N4/c1-4-11-5-7-12(8-6-11)15-17-13-9-10-14(20(2)3)18-16(13)19-15/h5-10H,4H2,1-3H3,(H,17,18,19)
InChIKeyQIUARKGJWCYDBY-UHFFFAOYSA-N
MW266.35 g/mol
LogP3.25
Rot. Bonds3

About 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine

2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79821611) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79821611
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCc1ccc(-c2nc3nc(N(C)C)ccc3[nH]2)cc1
InChIInChI=1S/C16H18N4/c1-4-11-5-7-12(8-6-11)15-17-13-9-10-14(20(2)3)18-16(13)19-15/h5-10H,4H2,1-3H3,(H,17,18,19)
InChIKeyQIUARKGJWCYDBY-UHFFFAOYSA-N
XLogP3.25
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-ethylphenyl)-N,N-dimethyl-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-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine (CID 79821611) is 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine is CCc1ccc(-c2nc3nc(N(C)C)ccc3[nH]2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is QIUARKGJWCYDBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-4-11-5-7-12(8-6-11)15-17-13-9-10-14(20(2)3)18-16(13)19-15/h5-10H,4H2,1-3H3,(H,17,18,19).
What are the key properties of 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 266.35 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79821611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).