1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine

C14H14N2S — CID 11608431

IUPAC1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine
SMILESCc1c(-c2cccs2)cnc2cc(C)n(C)c12
InChIInChI=1S/C14H14N2S/c1-9-7-12-14(16(9)3)10(2)11(8-15-12)13-5-4-6-17-13/h4-8H,1-3H3
InChIKeyCZAPYNUETMECAR-UHFFFAOYSA-N
MW242.35 g/mol
LogP3.92
Rot. Bonds1

About 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine

1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine (PubChem CID 11608431) has the molecular formula C14H14N2S and a molecular weight of 242.35 g/mol. Its IUPAC name is 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine
PubChem CID11608431
Molecular FormulaC14H14N2S
Molecular Weight242.35 g/mol
Exact Mass242.09
IUPAC Name1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine
SMILESCc1c(-c2cccs2)cnc2cc(C)n(C)c12
InChIInChI=1S/C14H14N2S/c1-9-7-12-14(16(9)3)10(2)11(8-15-12)13-5-4-6-17-13/h4-8H,1-3H3
InChIKeyCZAPYNUETMECAR-UHFFFAOYSA-N
XLogP3.92
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.35
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-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 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine?
The IUPAC name of 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine (CID 11608431) is 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine.
What is the SMILES notation for 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine?
The canonical SMILES for 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine is Cc1c(-c2cccs2)cnc2cc(C)n(C)c12.
What is the InChIKey of 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine?
The InChIKey is CZAPYNUETMECAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2S/c1-9-7-12-14(16(9)3)10(2)11(8-15-12)13-5-4-6-17-13/h4-8H,1-3H3.
What are the key properties of 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine?
1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine has a molecular weight of 242.35 g/mol, XLogP of 3.92, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,7-trimethyl-6-thiophen-2-ylpyrrolo[3,2-b]pyridine is sourced from PubChem (CID 11608431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).