N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide

C14H16N2O2S — CID 34953084

IUPACN-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide
SMILESCCOc1ncccc1NC(=O)c1cc(C)c(C)s1
InChIInChI=1S/C14H16N2O2S/c1-4-18-14-11(6-5-7-15-14)16-13(17)12-8-9(2)10(3)19-12/h5-8H,4H2,1-3H3,(H,16,17)
InChIKeyKYBAGAGFLZVEME-UHFFFAOYSA-N
MW276.36 g/mol
LogP3.41
Rot. Bonds4

About N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide

N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide (PubChem CID 34953084) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide
PubChem CID34953084
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide
SMILESCCOc1ncccc1NC(=O)c1cc(C)c(C)s1
InChIInChI=1S/C14H16N2O2S/c1-4-18-14-11(6-5-7-15-14)16-13(17)12-8-9(2)10(3)19-12/h5-8H,4H2,1-3H3,(H,16,17)
InChIKeyKYBAGAGFLZVEME-UHFFFAOYSA-N
XLogP3.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-{6-[3-(trifluoromethyl)phenoxy]-3-pyridinyl}-2-thiophenecarboxamide
CID 2814188
N-{6-[4-(tert-butyl)phenoxy]-3-pyridinyl}-2-thiophenecarboxamide
CID 2814266
N-pyridin-3-yl-4H-thieno[3,2-c]chromene-2-carboxamide
CID 20877944
1-(5-(4-(2-(Diethylamino)ethoxy)phenyl)-3-(pyridin-3-ylcarbamoyl)thiophen-2-yl)urea
CID 11648145
N-hydroxy-5-(5-((2-phenoxyethylamino)methyl)pyridin-2-yl)thiophene-2-carboxamide
CID 11696355
N-[(Z)-3-(4-methoxyanilino)-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]thiophene-2-carboxamide
CID 1919175
N-(furan-2-ylmethyl)-2-phenyl-2-[pyridin-3-yl-(2-thiophen-2-ylacetyl)amino]acetamide
CID 3216731
N-{2-[4-(tert-butyl)phenoxy]pyridin-3-yl}thiophene-2-carboxamide
CID 2728416
N-(6-methoxy-3-pyridinyl)-3-methyl-2-thiophenecarboxamide
CID 2466273
N-(6-methoxy-3-pyridinyl)-2-thiophenecarboxamide
CID 2747402
6-Cyclopropylmethoxy-5-methyl-pyridine-2-carboxylic acid (1-methyl-1-thiazol-2-yl-ethyl)-amide
CID 71105572
(4-Carbamimidoyl-2-fluorophenyl) 5-[3-[(2-methoxy-3-pyridinyl)amino]-2,2-dimethyl-3-oxopropyl]thiophene-2-carboxylate
CID 92044962

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide?
The IUPAC name of N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide (CID 34953084) is N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide?
The canonical SMILES for N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide is CCOc1ncccc1NC(=O)c1cc(C)c(C)s1.
What is the InChIKey of N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide?
The InChIKey is KYBAGAGFLZVEME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-4-18-14-11(6-5-7-15-14)16-13(17)12-8-9(2)10(3)19-12/h5-8H,4H2,1-3H3,(H,16,17).
What are the key properties of N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide?
N-(2-ethoxy-3-pyridinyl)-4,5-dimethylthiophene-2-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 3.41, 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)-4,5-dimethylthiophene-2-carboxamide is sourced from PubChem (CID 34953084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).