N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide

C20H18N2O2S — CID 2992339

IUPACN-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccccc1C(=O)NCCc1ccccc1)c1cccs1
InChIInChI=1S/C20H18N2O2S/c23-19(21-13-12-15-7-2-1-3-8-15)16-9-4-5-10-17(16)22-20(24)18-11-6-14-25-18/h1-11,14H,12-13H2,(H,21,23)(H,22,24)
InChIKeyFGFHRYNQOVCCGV-UHFFFAOYSA-N
MW350.44 g/mol
LogP3.97
Rot. Bonds6

About N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide

N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide (PubChem CID 2992339) has the molecular formula C20H18N2O2S and a molecular weight of 350.44 g/mol. Its IUPAC name is N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide
PubChem CID2992339
Molecular FormulaC20H18N2O2S
Molecular Weight350.44 g/mol
Exact Mass350.11
IUPAC NameN-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccccc1C(=O)NCCc1ccccc1)c1cccs1
InChIInChI=1S/C20H18N2O2S/c23-19(21-13-12-15-7-2-1-3-8-15)16-9-4-5-10-17(16)22-20(24)18-11-6-14-25-18/h1-11,14H,12-13H2,(H,21,23)(H,22,24)
InChIKeyFGFHRYNQOVCCGV-UHFFFAOYSA-N
XLogP3.97
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.44
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(pyridin-4-ylmethylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 24653521
[2-(2-phenylethylcarbamoyl)phenyl]carbamothioic S-acid
CID 155166285
N-[2-[(4-chlorophenyl)methylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 23913368
4-oxo-4-[2-(2-phenylethylcarbamoyl)anilino]but-2-enoic acid
CID 4929672
N-(2-phenylethyl)-2-[[2-(1-thiophen-2-ylethylamino)acetyl]amino]benzamide
CID 17453541
2-[[2-[(2-phenylacetyl)amino]acetyl]amino]-N-(2-phenylethyl)benzamide
CID 33252278
4-(2-phenylethyl)-2-(thiophene-2-carbonylamino)benzoic acid
CID 67344551
4-[2-(thiophene-2-carbonylamino)ethyl]benzoic acid
CID 43233765
N-[2-[[2-(2-bromoanilino)-2-oxoethyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 24681758
1-N,4-N-bis[2-(2-phenylethylcarbamoyl)phenyl]cyclohexane-1,4-dicarboxamide
CID 4930342
N-[2-(3-phenylpropoxy)phenyl]thiophene-2-carboxamide
CID 17131369
N-[2-(2-phenylethylcarbamoyl)phenyl]furan-3-carboxamide
CID 18102051

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide (CID 2992339) is N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide is O=C(Nc1ccccc1C(=O)NCCc1ccccc1)c1cccs1.
What is the InChIKey of N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide?
The InChIKey is FGFHRYNQOVCCGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2S/c23-19(21-13-12-15-7-2-1-3-8-15)16-9-4-5-10-17(16)22-20(24)18-11-6-14-25-18/h1-11,14H,12-13H2,(H,21,23)(H,22,24).
What are the key properties of N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide?
N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide has a molecular weight of 350.44 g/mol, XLogP of 3.97, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-phenylethylcarbamoyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 2992339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).