N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide

C20H14N2O3S — CID 1016193

IUPACN-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1cc2ccccc2o1
InChIInChI=1S/C20H14N2O3S/c23-19(17-12-13-4-1-2-5-16(13)25-17)21-14-7-9-15(10-8-14)22-20(24)18-6-3-11-26-18/h1-12H,(H,21,23)(H,22,24)
InChIKeyFWCJQKREAWTSDZ-UHFFFAOYSA-N
MW362.41 g/mol
LogP5.00
Rot. Bonds4

About N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide

N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide (PubChem CID 1016193) has the molecular formula C20H14N2O3S and a molecular weight of 362.41 g/mol. Its IUPAC name is N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
PubChem CID1016193
Molecular FormulaC20H14N2O3S
Molecular Weight362.41 g/mol
Exact Mass362.07
IUPAC NameN-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1cc2ccccc2o1
InChIInChI=1S/C20H14N2O3S/c23-19(17-12-13-4-1-2-5-16(13)25-17)21-14-7-9-15(10-8-14)22-20(24)18-6-3-11-26-18/h1-12H,(H,21,23)(H,22,24)
InChIKeyFWCJQKREAWTSDZ-UHFFFAOYSA-N
XLogP5.00
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
CID 1232080
N-(4-iodophenyl)-1-benzofuran-2-carboxamide
CID 986281
N-[(thiophene-2-carbonylamino)carbamothioyl]-1-benzofuran-2-carboxamide
CID 3319055
N-(4-sulfamoylphenyl)-1-benzofuran-2-carboxamide
CID 744283
[4-(1-benzofuran-2-carbonylamino)phenyl] acetate
CID 6457571
N-[4-[4-(thiophene-2-carbonylamino)anilino]phenyl]thiophene-2-carboxamide
CID 67687159
N-(1,3-benzothiazol-6-yl)-1-benzofuran-2-carboxamide
CID 16858046
N-[4-(1,3-benzoxazol-2-ylmethyl)phenyl]-1-benzofuran-2-carboxamide
CID 54858220
N-(3-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24708217
N-[4-[2-(methoxyamino)-2-oxoethyl]phenyl]-1-benzofuran-2-carboxamide
CID 60572574
2-[(4-fluorosulfonyloxyphenyl)carbamoyl]-1-benzofuran
CID 146097133
N-[4-[(2,4-dichlorobenzoyl)amino]phenyl]-1-benzofuran-2-carboxamide
CID 1107583

Frequently Asked Questions

What is the IUPAC name of N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide (CID 1016193) is N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide is O=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1cc2ccccc2o1.
What is the InChIKey of N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide?
The InChIKey is FWCJQKREAWTSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O3S/c23-19(17-12-13-4-1-2-5-16(13)25-17)21-14-7-9-15(10-8-14)22-20(24)18-6-3-11-26-18/h1-12H,(H,21,23)(H,22,24).
What are the key properties of N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide?
N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide has a molecular weight of 362.41 g/mol, XLogP of 5.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 1016193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).