5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide

C13H12ClNOS — CID 7750910

IUPAC5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccc(Cl)s1
InChIInChI=1S/C13H12ClNOS/c1-2-9-5-3-4-6-10(9)15-13(16)11-7-8-12(14)17-11/h3-8H,2H2,1H3,(H,15,16)
InChIKeyRQJZTNLYINAIHR-UHFFFAOYSA-N
MW265.77 g/mol
LogP4.22
Rot. Bonds3

About 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide

5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide (PubChem CID 7750910) has the molecular formula C13H12ClNOS and a molecular weight of 265.77 g/mol. Its IUPAC name is 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide
PubChem CID7750910
Molecular FormulaC13H12ClNOS
Molecular Weight265.77 g/mol
Exact Mass265.03
IUPAC Name5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccc(Cl)s1
InChIInChI=1S/C13H12ClNOS/c1-2-9-5-3-4-6-10(9)15-13(16)11-7-8-12(14)17-11/h3-8H,2H2,1H3,(H,15,16)
InChIKeyRQJZTNLYINAIHR-UHFFFAOYSA-N
XLogP4.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.77
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-N-[2-(hydroxymethyl)phenyl]thiophene-2-carboxamide
CID 54960567
N-[2-(bromomethyl)phenyl]-5-ethylthiophene-2-carboxamide
CID 113274434
4-(5-chlorothiophen-2-yl)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-4-oxobutanamide
CID 51163475
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337
5-chloro-N-(2-phenoxyphenyl)thiophene-2-carboxamide
CID 841081
2-amino-N-(2-ethylphenyl)-1,3-thiazole-5-carboxamide
CID 141271026
N-[2-(2-aminoethylcarbamoyl)phenyl]-5-chlorothiophene-2-carboxamide
CID 107000040
1-(5-chlorothiophen-2-yl)-3-(2-ethylanilino)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate
CID 8861463
N-(2-ethylphenyl)-5-pyrrolidin-1-ylsulfonylthiophene-2-carboxamide
CID 53066353
5-(1,3-benzothiazol-2-yl)-N-(2-ethylphenyl)thiophene-2-carboxamide
CID 4731587
5-chloro-N-[2-[(E)-N'-hydroxycarbamimidoyl]phenyl]thiophene-2-carboxamide
CID 55037454
2-(5-chlorothiophen-2-yl)-N-(2-ethylphenyl)quinoline-4-carboxamide
CID 3457981

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide (CID 7750910) is 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide is CCc1ccccc1NC(=O)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide?
The InChIKey is RQJZTNLYINAIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNOS/c1-2-9-5-3-4-6-10(9)15-13(16)11-7-8-12(14)17-11/h3-8H,2H2,1H3,(H,15,16).
What are the key properties of 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide?
5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide has a molecular weight of 265.77 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-ethylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 7750910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).