N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide

C19H15ClN2O2S — CID 1347156

IUPACN-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C19H15ClN2O2S/c20-14-5-3-13(4-6-14)12-18(23)21-15-7-9-16(10-8-15)22-19(24)17-2-1-11-25-17/h1-11H,12H2,(H,21,23)(H,22,24)
InChIKeyLYBBBTXASDTIDA-UHFFFAOYSA-N
MW370.86 g/mol
LogP4.84
Rot. Bonds5

About N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide

N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide (PubChem CID 1347156) has the molecular formula C19H15ClN2O2S and a molecular weight of 370.86 g/mol. Its IUPAC name is N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide
PubChem CID1347156
Molecular FormulaC19H15ClN2O2S
Molecular Weight370.86 g/mol
Exact Mass370.05
IUPAC NameN-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C19H15ClN2O2S/c20-14-5-3-13(4-6-14)12-18(23)21-15-7-9-16(10-8-15)22-19(24)17-2-1-11-25-17/h1-11H,12H2,(H,21,23)(H,22,24)
InChIKeyLYBBBTXASDTIDA-UHFFFAOYSA-N
XLogP4.84
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.86
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-{4-chloro-2-[(4-chlorophenyl)carbamoyl]phenyl}-4-[(methylsulfanyl)methyl]thiophene-2-carboxamide
CID 18376839
5-chloro-N-(2-(4-(2-oxopyridin-1(2H)-yl)benzamido)ethyl)thiophene-2-carboxamide
CID 10250490
3-chloro-N-{4-chloro-2-[(4-chlorophenyl)carbamoyl]phenyl}-5-methylthiophene-2-carboxamide
CID 18376748
3-chloro-N-{4-chloro-2-[(4-chlorophenyl)carbamoyl]phenyl}-4-methylthiophene-2-carboxamide
CID 18377010
3-Chloro-N-(4-methylphenyl)-1-benzothiophene-2-carboxamide
CID 606829
N-[2-chloro-5-(hydroxycarbamoyl)phenyl]-1-benzothiophene-7-carboxamide
CID 134822021
N-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]-4-thiophen-3-ylbenzamide
CID 155521711
N-[2-(phenylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 715970
N-(5-chlorothiophen-3-yl)benzamide
CID 901515
N-[3-[(4-fluorobenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 960351
N-(3-chloro-2-methylphenyl)-4-oxo-4-thiophen-2-ylbutanamide
CID 2413150
N-{4-[(2-phenylacetyl)amino]phenyl}-2-thiophenecarboxamide
CID 3162290

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide (CID 1347156) is N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide is O=C(Cc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2cccs2)cc1.
What is the InChIKey of N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
The InChIKey is LYBBBTXASDTIDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O2S/c20-14-5-3-13(4-6-14)12-18(23)21-15-7-9-16(10-8-15)22-19(24)17-2-1-11-25-17/h1-11H,12H2,(H,21,23)(H,22,24).
What are the key properties of N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide has a molecular weight of 370.86 g/mol, XLogP of 4.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 1347156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).