N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide

C12H12N2O2S — CID 34958268

IUPACN-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide
SMILESCCOc1ncccc1NC(=O)c1cccs1
InChIInChI=1S/C12H12N2O2S/c1-2-16-12-9(5-3-7-13-12)14-11(15)10-6-4-8-17-10/h3-8H,2H2,1H3,(H,14,15)
InChIKeyJEKCBCPATBQZLF-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.79
Rot. Bonds4

About N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide

N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide (PubChem CID 34958268) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide
PubChem CID34958268
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC NameN-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide
SMILESCCOc1ncccc1NC(=O)c1cccs1
InChIInChI=1S/C12H12N2O2S/c1-2-16-12-9(5-3-7-13-12)14-11(15)10-6-4-8-17-10/h3-8H,2H2,1H3,(H,14,15)
InChIKeyJEKCBCPATBQZLF-UHFFFAOYSA-N
XLogP2.79
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide 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 N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide (CID 34958268) is N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide is CCOc1ncccc1NC(=O)c1cccs1.
What is the InChIKey of N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide?
The InChIKey is JEKCBCPATBQZLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-2-16-12-9(5-3-7-13-12)14-11(15)10-6-4-8-17-10/h3-8H,2H2,1H3,(H,14,15).
What are the key properties of N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide?
N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide has a molecular weight of 248.31 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-3-pyridinyl)thiophene-2-carboxamide is sourced from PubChem (CID 34958268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).