2-benzamido-5-phenylthiophene-3-carboxamide

C18H14N2O2S — CID 15920759

IUPAC2-benzamido-5-phenylthiophene-3-carboxamide
SMILESNC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1ccccc1
InChIInChI=1S/C18H14N2O2S/c19-16(21)14-11-15(12-7-3-1-4-8-12)23-18(14)20-17(22)13-9-5-2-6-10-13/h1-11H,(H2,19,21)(H,20,22)
InChIKeyKCZRFLUSSWJMMU-UHFFFAOYSA-N
MW322.39 g/mol
LogP3.77
Rot. Bonds4

About 2-benzamido-5-phenylthiophene-3-carboxamide

2-benzamido-5-phenylthiophene-3-carboxamide (PubChem CID 15920759) has the molecular formula C18H14N2O2S and a molecular weight of 322.39 g/mol. Its IUPAC name is 2-benzamido-5-phenylthiophene-3-carboxamide.

Molecular Properties

Compound Name2-benzamido-5-phenylthiophene-3-carboxamide
PubChem CID15920759
Molecular FormulaC18H14N2O2S
Molecular Weight322.39 g/mol
Exact Mass322.08
IUPAC Name2-benzamido-5-phenylthiophene-3-carboxamide
SMILESNC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1ccccc1
InChIInChI=1S/C18H14N2O2S/c19-16(21)14-11-15(12-7-3-1-4-8-12)23-18(14)20-17(22)13-9-5-2-6-10-13/h1-11H,(H2,19,21)(H,20,22)
InChIKeyKCZRFLUSSWJMMU-UHFFFAOYSA-N
XLogP3.77
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Tpca-1
CID 9903786
2-Amino-5-phenylthiophene-3-carboxamide
CID 703965
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-fluorobenzamide
CID 766948
N,N-Diethyl-2-[(2-thienylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 1190625
5-Phenyl-2-Ureidothiophene-3-Carboxamide
CID 6419765
3-(Carbamoylamino)-5-Phenylthiophene-2-Carboxamide
CID 10220851
6-Tert-butyl-2-[(2,6-difluorobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 3604361
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-Benzamido-5-phenylthiophene-3-carboxylic acid
CID 709215

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-5-phenylthiophene-3-carboxamide?
The IUPAC name of 2-benzamido-5-phenylthiophene-3-carboxamide (CID 15920759) is 2-benzamido-5-phenylthiophene-3-carboxamide.
What is the SMILES notation for 2-benzamido-5-phenylthiophene-3-carboxamide?
The canonical SMILES for 2-benzamido-5-phenylthiophene-3-carboxamide is NC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1ccccc1.
What is the InChIKey of 2-benzamido-5-phenylthiophene-3-carboxamide?
The InChIKey is KCZRFLUSSWJMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2S/c19-16(21)14-11-15(12-7-3-1-4-8-12)23-18(14)20-17(22)13-9-5-2-6-10-13/h1-11H,(H2,19,21)(H,20,22).
What are the key properties of 2-benzamido-5-phenylthiophene-3-carboxamide?
2-benzamido-5-phenylthiophene-3-carboxamide has a molecular weight of 322.39 g/mol, XLogP of 3.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-5-phenylthiophene-3-carboxamide is sourced from PubChem (CID 15920759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).