N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide

C19H16N2O3S — CID 1352798

IUPACN-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cccs1
InChIInChI=1S/C19H16N2O3S/c1-24-16-10-9-13(18(22)20-14-6-3-2-4-7-14)12-15(16)21-19(23)17-8-5-11-25-17/h2-12H,1H3,(H,20,22)(H,21,23)
InChIKeyJCOJRVAWPBFHJH-UHFFFAOYSA-N
MW352.42 g/mol
LogP4.26
Rot. Bonds5

About N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide

N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide (PubChem CID 1352798) has the molecular formula C19H16N2O3S and a molecular weight of 352.42 g/mol. Its IUPAC name is N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide
PubChem CID1352798
Molecular FormulaC19H16N2O3S
Molecular Weight352.42 g/mol
Exact Mass352.09
IUPAC NameN-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cccs1
InChIInChI=1S/C19H16N2O3S/c1-24-16-10-9-13(18(22)20-14-6-3-2-4-7-14)12-15(16)21-19(23)17-8-5-11-25-17/h2-12H,1H3,(H,20,22)(H,21,23)
InChIKeyJCOJRVAWPBFHJH-UHFFFAOYSA-N
XLogP4.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-Amino-4-methoxybenzanilide
CID 8426
N-[2-amino-5-(thiophen-2-yl)phenyl]-4-methoxybenzamide
CID 23648268
N-(2-methoxyphenyl)-2-(methylthio)benzamide
CID 313103
N-(4-Methylphenyl)-4-(propan-2-yloxy)-N-[(thiophen-2-YL)methyl]benzamide
CID 16015899
N-[4-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]butyl]-4-thiophen-3-ylbenzamide
CID 71659909
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-4-thiophen-3-ylbenzamide
CID 155560516
Thiophene-2-carboxylic acid (4-methoxy-biphenyl-3-yl)-amide
CID 1109361
N-{2-[(2-methoxyanilino)carbonyl]phenyl}-2-thiophenecarboxamide
CID 1116978
N-(2-Ethoxyphenyl)-4,5-dimethyl-3-thiophenecarboxamide
CID 1245175
N-(2-methoxyphenyl)-2-thiophen-3-ylacetamide
CID 16234675
3-[[(4-Methoxyphenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester
CID 844198
N-{4-[(4-ethoxy-3-nitrobenzoyl)amino]phenyl}-2-thiophenecarboxamide
CID 3697247

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide (CID 1352798) is N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide is COc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cccs1.
What is the InChIKey of N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide?
The InChIKey is JCOJRVAWPBFHJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3S/c1-24-16-10-9-13(18(22)20-14-6-3-2-4-7-14)12-15(16)21-19(23)17-8-5-11-25-17/h2-12H,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide?
N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide has a molecular weight of 352.42 g/mol, XLogP of 4.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-5-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 1352798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).