5-(4-chlorophenyl)thiophene-2-carboxamide

C11H8ClNOS — CID 613585

IUPAC5-(4-chlorophenyl)thiophene-2-carboxamide
SMILESNC(=O)c1ccc(-c2ccc(Cl)cc2)s1
InChIInChI=1S/C11H8ClNOS/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H2,13,14)
InChIKeyJXYHJZWEDUROGS-UHFFFAOYSA-N
MW237.71 g/mol
LogP3.17
Rot. Bonds2

About 5-(4-chlorophenyl)thiophene-2-carboxamide

5-(4-chlorophenyl)thiophene-2-carboxamide (PubChem CID 613585) has the molecular formula C11H8ClNOS and a molecular weight of 237.71 g/mol. Its IUPAC name is 5-(4-chlorophenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)thiophene-2-carboxamide
PubChem CID613585
Molecular FormulaC11H8ClNOS
Molecular Weight237.71 g/mol
Exact Mass237.00
IUPAC Name5-(4-chlorophenyl)thiophene-2-carboxamide
SMILESNC(=O)c1ccc(-c2ccc(Cl)cc2)s1
InChIInChI=1S/C11H8ClNOS/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H2,13,14)
InChIKeyJXYHJZWEDUROGS-UHFFFAOYSA-N
XLogP3.17
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.71
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)thiophene-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)thiophene-2-carboxamide (CID 613585) is 5-(4-chlorophenyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)thiophene-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)thiophene-2-carboxamide is NC(=O)c1ccc(-c2ccc(Cl)cc2)s1.
What is the InChIKey of 5-(4-chlorophenyl)thiophene-2-carboxamide?
The InChIKey is JXYHJZWEDUROGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClNOS/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H2,13,14).
What are the key properties of 5-(4-chlorophenyl)thiophene-2-carboxamide?
5-(4-chlorophenyl)thiophene-2-carboxamide has a molecular weight of 237.71 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)thiophene-2-carboxamide is sourced from PubChem (CID 613585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).