2-(carbamoylamino)-5-phenylthiophene-3-carboxamide

C12H11N3O2S — CID 6419765

IUPAC2-(carbamoylamino)-5-phenylthiophene-3-carboxamide
SMILESNC(=O)Nc1sc(-c2ccccc2)cc1C(N)=O
InChIInChI=1S/C12H11N3O2S/c13-10(16)8-6-9(7-4-2-1-3-5-7)18-11(8)15-12(14)17/h1-6H,(H2,13,16)(H3,14,15,17)
InChIKeyPSVUSJKZJQMCSP-UHFFFAOYSA-N
MW261.31 g/mol
LogP2.00
Rot. Bonds3

About 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide

2-(carbamoylamino)-5-phenylthiophene-3-carboxamide (PubChem CID 6419765) has the molecular formula C12H11N3O2S and a molecular weight of 261.31 g/mol. Its IUPAC name is 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide.

Molecular Properties

Compound Name2-(carbamoylamino)-5-phenylthiophene-3-carboxamide
PubChem CID6419765
Molecular FormulaC12H11N3O2S
Molecular Weight261.31 g/mol
Exact Mass261.06
IUPAC Name2-(carbamoylamino)-5-phenylthiophene-3-carboxamide
SMILESNC(=O)Nc1sc(-c2ccccc2)cc1C(N)=O
InChIInChI=1S/C12H11N3O2S/c13-10(16)8-6-9(7-4-2-1-3-5-7)18-11(8)15-12(14)17/h1-6H,(H2,13,16)(H3,14,15,17)
InChIKeyPSVUSJKZJQMCSP-UHFFFAOYSA-N
XLogP2.00
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.31
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tpca-1
CID 9903786
2-Amino-5-phenylthiophene-3-carboxamide
CID 703965
3-(Carbamoylamino)-5-Phenylthiophene-2-Carboxamide
CID 10220851
2-(Carbamoylamino)-5-Phenyl-N-[(3s)-Piperidin-3-Yl]thiophene-3-Carboxamide
CID 11313946
2-(2-(Benzo[b]thiophen-3-yl)acetamido)thiophene-3-carboxamide
CID 46926788
2-[(2-Fluorobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 700253
2-Benzamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
CID 678544
2-Benzoylamino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid amide
CID 712900
N-(3-benzoylthien-2-yl)-2-chloroacetamide
CID 819037
N-(5-Methyl-2-thienyl)benzamide
CID 570111
N-(4,5-dimethylthiophen-2-yl)benzamide
CID 570162
N-(3-Benzoyl-4,5-dimethyl-thiophen-2-yl)-2-chloro-acetamide
CID 615593

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide?
The IUPAC name of 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide (CID 6419765) is 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide.
What is the SMILES notation for 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide?
The canonical SMILES for 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide is NC(=O)Nc1sc(-c2ccccc2)cc1C(N)=O.
What is the InChIKey of 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide?
The InChIKey is PSVUSJKZJQMCSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2S/c13-10(16)8-6-9(7-4-2-1-3-5-7)18-11(8)15-12(14)17/h1-6H,(H2,13,16)(H3,14,15,17).
What are the key properties of 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide?
2-(carbamoylamino)-5-phenylthiophene-3-carboxamide has a molecular weight of 261.31 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-5-phenylthiophene-3-carboxamide is sourced from PubChem (CID 6419765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).