2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine

C14H16N4S — CID 79975037

IUPAC2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCc1ccsc1-c1nc2nc(N(C)C)ccc2[nH]1
InChIInChI=1S/C14H16N4S/c1-4-9-7-8-19-12(9)14-15-10-5-6-11(18(2)3)16-13(10)17-14/h5-8H,4H2,1-3H3,(H,15,16,17)
InChIKeyWFJNECUZRWMTJQ-UHFFFAOYSA-N
MW272.38 g/mol
LogP3.31
Rot. Bonds3

About 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine

2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79975037) has the molecular formula C14H16N4S and a molecular weight of 272.38 g/mol. Its IUPAC name is 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79975037
Molecular FormulaC14H16N4S
Molecular Weight272.38 g/mol
Exact Mass272.11
IUPAC Name2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCc1ccsc1-c1nc2nc(N(C)C)ccc2[nH]1
InChIInChI=1S/C14H16N4S/c1-4-9-7-8-19-12(9)14-15-10-5-6-11(18(2)3)16-13(10)17-14/h5-8H,4H2,1-3H3,(H,15,16,17)
InChIKeyWFJNECUZRWMTJQ-UHFFFAOYSA-N
XLogP3.31
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-ethylthiophen-2-yl)-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-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine (CID 79975037) is 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine is CCc1ccsc1-c1nc2nc(N(C)C)ccc2[nH]1.
What is the InChIKey of 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is WFJNECUZRWMTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4S/c1-4-9-7-8-19-12(9)14-15-10-5-6-11(18(2)3)16-13(10)17-14/h5-8H,4H2,1-3H3,(H,15,16,17).
What are the key properties of 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 272.38 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylthiophen-2-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79975037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).