N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide

C13H14N2O2S — CID 34958874

IUPACN-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide
SMILESCCOc1ncccc1NC(=O)c1ccc(C)s1
InChIInChI=1S/C13H14N2O2S/c1-3-17-13-10(5-4-8-14-13)15-12(16)11-7-6-9(2)18-11/h4-8H,3H2,1-2H3,(H,15,16)
InChIKeyCBWUHTPZEXHFDJ-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.10
Rot. Bonds4

About N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide

N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide (PubChem CID 34958874) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide
PubChem CID34958874
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC NameN-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide
SMILESCCOc1ncccc1NC(=O)c1ccc(C)s1
InChIInChI=1S/C13H14N2O2S/c1-3-17-13-10(5-4-8-14-13)15-12(16)11-7-6-9(2)18-11/h4-8H,3H2,1-2H3,(H,15,16)
InChIKeyCBWUHTPZEXHFDJ-UHFFFAOYSA-N
XLogP3.10
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-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)-5-methylthiophene-2-carboxamide?
The IUPAC name of N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide (CID 34958874) is N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide is CCOc1ncccc1NC(=O)c1ccc(C)s1.
What is the InChIKey of N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide?
The InChIKey is CBWUHTPZEXHFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-3-17-13-10(5-4-8-14-13)15-12(16)11-7-6-9(2)18-11/h4-8H,3H2,1-2H3,(H,15,16).
What are the key properties of N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide?
N-(2-ethoxy-3-pyridinyl)-5-methylthiophene-2-carboxamide has a molecular weight of 262.33 g/mol, XLogP of 3.10, 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)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 34958874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).