N-(3-carbamoylphenyl)thiophene-3-carboxamide

C12H10N2O2S — CID 17015852

IUPACN-(3-carbamoylphenyl)thiophene-3-carboxamide
SMILESNC(=O)c1cccc(NC(=O)c2ccsc2)c1
InChIInChI=1S/C12H10N2O2S/c13-11(15)8-2-1-3-10(6-8)14-12(16)9-4-5-17-7-9/h1-7H,(H2,13,15)(H,14,16)
InChIKeySRRGQUHYDNCFQO-UHFFFAOYSA-N
MW246.29 g/mol
LogP2.10
Rot. Bonds3

About N-(3-carbamoylphenyl)thiophene-3-carboxamide

N-(3-carbamoylphenyl)thiophene-3-carboxamide (PubChem CID 17015852) has the molecular formula C12H10N2O2S and a molecular weight of 246.29 g/mol. Its IUPAC name is N-(3-carbamoylphenyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(3-carbamoylphenyl)thiophene-3-carboxamide
PubChem CID17015852
Molecular FormulaC12H10N2O2S
Molecular Weight246.29 g/mol
Exact Mass246.05
IUPAC NameN-(3-carbamoylphenyl)thiophene-3-carboxamide
SMILESNC(=O)c1cccc(NC(=O)c2ccsc2)c1
InChIInChI=1S/C12H10N2O2S/c13-11(15)8-2-1-3-10(6-8)14-12(16)9-4-5-17-7-9/h1-7H,(H2,13,15)(H,14,16)
InChIKeySRRGQUHYDNCFQO-UHFFFAOYSA-N
XLogP2.10
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(aminomethyl)phenyl]thiophene-3-carboxamide
CID 63254340
N-[3-(sulfamoylamino)phenyl]thiophene-3-carboxamide
CID 60728385
N-(3-sulfamoylphenyl)thiophene-3-carboxamide
CID 60656415
3-[(3-hydroxybenzoyl)amino]benzamide
CID 103605136
N-[3-(2,2,2-trifluoroethylcarbamoyl)phenyl]thiophene-3-carboxamide
CID 17444241
N-(4-carbamoyl-3-chlorophenyl)thiophene-3-carboxamide
CID 39170420
N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide
CID 113372023
N-(3-carbamoylphenyl)-4-(thiophene-3-carbonyl)-1,4-diazepane-1-carboxamide
CID 87035062
3-carbamothioyl-N-(3-carbamoylphenyl)benzamide
CID 107811391
N-(4-amino-3-chlorophenyl)thiophene-3-carboxamide
CID 82862106
3-hydroxy-N-thiophen-3-ylbenzamide
CID 66353330
3-(aminomethyl)-N-(3-carbamoylphenyl)benzamide
CID 102978279

Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoylphenyl)thiophene-3-carboxamide?
The IUPAC name of N-(3-carbamoylphenyl)thiophene-3-carboxamide (CID 17015852) is N-(3-carbamoylphenyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(3-carbamoylphenyl)thiophene-3-carboxamide?
The canonical SMILES for N-(3-carbamoylphenyl)thiophene-3-carboxamide is NC(=O)c1cccc(NC(=O)c2ccsc2)c1.
What is the InChIKey of N-(3-carbamoylphenyl)thiophene-3-carboxamide?
The InChIKey is SRRGQUHYDNCFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2S/c13-11(15)8-2-1-3-10(6-8)14-12(16)9-4-5-17-7-9/h1-7H,(H2,13,15)(H,14,16).
What are the key properties of N-(3-carbamoylphenyl)thiophene-3-carboxamide?
N-(3-carbamoylphenyl)thiophene-3-carboxamide has a molecular weight of 246.29 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoylphenyl)thiophene-3-carboxamide is sourced from PubChem (CID 17015852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).