3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide

C11H9ClN2OS — CID 61092440

IUPAC3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C11H9ClN2OS/c12-7-1-3-8(4-2-7)14-11(15)10-9(13)5-6-16-10/h1-6H,13H2,(H,14,15)
InChIKeySZOXGWWAOVUUNB-UHFFFAOYSA-N
MW252.73 g/mol
LogP3.24
Rot. Bonds2

About 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide

3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide (PubChem CID 61092440) has the molecular formula C11H9ClN2OS and a molecular weight of 252.73 g/mol. Its IUPAC name is 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide
PubChem CID61092440
Molecular FormulaC11H9ClN2OS
Molecular Weight252.73 g/mol
Exact Mass252.01
IUPAC Name3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C11H9ClN2OS/c12-7-1-3-8(4-2-7)14-11(15)10-9(13)5-6-16-10/h1-6H,13H2,(H,14,15)
InChIKeySZOXGWWAOVUUNB-UHFFFAOYSA-N
XLogP3.24
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.73
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(5-chloro-2-pyridinyl)thiophene-2-carboxamide
CID 61094139
N-(4-chlorophenyl)-3-methylthiophene-2-carboxamide
CID 26087540
3-amino-N-(4-ethylphenyl)thiophene-2-carboxamide
CID 61089660
3-amino-N-[4-fluoro-3-(trifluoromethyl)phenyl]thiophene-2-carboxamide
CID 61228423
3-amino-N-[4-(dimethylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 61117853
propan-2-yl 4-[(3-aminothiophene-2-carbonyl)amino]benzoate
CID 61118465
3-amino-N-(4-piperidin-1-ylphenyl)thiophene-2-carboxamide
CID 61110951
3-amino-N-[4-(cyclopropylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 61110938
N-(3-amino-4-chlorophenyl)-3-chlorothiophene-2-carboxamide
CID 80645311
3-amino-N-[3,5-dichloro-4-(difluoromethoxy)phenyl]thiophene-2-carboxamide
CID 61104305
3-amino-N-[4-(1,2,4-triazol-1-yl)phenyl]thiophene-2-carboxamide
CID 61102206
3-amino-N-(4-bromo-3,5-dimethylphenyl)thiophene-2-carboxamide
CID 107571089

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide (CID 61092440) is 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide is Nc1ccsc1C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide?
The InChIKey is SZOXGWWAOVUUNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2OS/c12-7-1-3-8(4-2-7)14-11(15)10-9(13)5-6-16-10/h1-6H,13H2,(H,14,15).
What are the key properties of 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide?
3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide has a molecular weight of 252.73 g/mol, XLogP of 3.24, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide is sourced from PubChem (CID 61092440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).