2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide

C16H14N2OS2 — CID 53119776

IUPAC2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide
SMILESO=C(NCCc1cccs1)c1ccnc(-c2ccsc2)c1
InChIInChI=1S/C16H14N2OS2/c19-16(18-7-4-14-2-1-8-21-14)12-3-6-17-15(10-12)13-5-9-20-11-13/h1-3,5-6,8-11H,4,7H2,(H,18,19)
InChIKeyQGJYGODQDJBEIW-UHFFFAOYSA-N
MW314.44 g/mol
LogP3.84
Rot. Bonds5

About 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide

2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide (PubChem CID 53119776) has the molecular formula C16H14N2OS2 and a molecular weight of 314.44 g/mol. Its IUPAC name is 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide
PubChem CID53119776
Molecular FormulaC16H14N2OS2
Molecular Weight314.44 g/mol
Exact Mass314.05
IUPAC Name2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide
SMILESO=C(NCCc1cccs1)c1ccnc(-c2ccsc2)c1
InChIInChI=1S/C16H14N2OS2/c19-16(18-7-4-14-2-1-8-21-14)12-3-6-17-15(10-12)13-5-9-20-11-13/h1-3,5-6,8-11H,4,7H2,(H,18,19)
InChIKeyQGJYGODQDJBEIW-UHFFFAOYSA-N
XLogP3.84
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.44
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-fluorophenyl)methyl]-2-thiophen-3-ylpyridine-4-carboxamide
CID 53036787
N-[(3-methylphenyl)methyl]-2-thiophen-3-ylpyridine-4-carboxamide
CID 53036784
3-chloro-N-(2-thiophen-2-ylethyl)benzamide
CID 18111212
4-hydrazinyl-N-(2-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 62249935
N-(2-thiophen-2-ylethyl)-1,3-thiazole-4-carboxamide
CID 62044830
3-pyrrol-1-yl-N-(2-thiophen-2-ylethyl)benzamide
CID 17453938
9-oxo-N-(2-thiophen-2-ylethyl)fluorene-2-carboxamide
CID 16612942
4-(1H-imidazol-2-yl)-N-(2-thiophen-2-ylethyl)benzamide
CID 110690194
2-chloro-N-(2-thiophen-2-ylethyl)pyridine-3-carboxamide
CID 18071300
4-sulfanyl-N-(2-thiophen-2-ylethyl)benzamide
CID 107021162
4-(2-thiophen-3-ylethylcarbamoyl)pyridine-2-carboxylic acid
CID 113352919
4-bromo-3-fluoro-N-(2-thiophen-2-ylethyl)benzamide
CID 47421945

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide (CID 53119776) is 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide is O=C(NCCc1cccs1)c1ccnc(-c2ccsc2)c1.
What is the InChIKey of 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide?
The InChIKey is QGJYGODQDJBEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS2/c19-16(18-7-4-14-2-1-8-21-14)12-3-6-17-15(10-12)13-5-9-20-11-13/h1-3,5-6,8-11H,4,7H2,(H,18,19).
What are the key properties of 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide?
2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide has a molecular weight of 314.44 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-3-yl-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 53119776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).