2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide

C19H16ClNOS — CID 90596848

IUPAC2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccccc1-c1ccsc1
InChIInChI=1S/C19H16ClNOS/c20-17-7-5-14(6-8-17)11-19(22)21-12-15-3-1-2-4-18(15)16-9-10-23-13-16/h1-10,13H,11-12H2,(H,21,22)
InChIKeyNWZNFSZUEBZGHE-UHFFFAOYSA-N
MW341.86 g/mol
LogP4.93
Rot. Bonds5

About 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide

2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide (PubChem CID 90596848) has the molecular formula C19H16ClNOS and a molecular weight of 341.86 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
PubChem CID90596848
Molecular FormulaC19H16ClNOS
Molecular Weight341.86 g/mol
Exact Mass341.06
IUPAC Name2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccccc1-c1ccsc1
InChIInChI=1S/C19H16ClNOS/c20-17-7-5-14(6-8-17)11-19(22)21-12-15-3-1-2-4-18(15)16-9-10-23-13-16/h1-10,13H,11-12H2,(H,21,22)
InChIKeyNWZNFSZUEBZGHE-UHFFFAOYSA-N
XLogP4.93
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.86
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethoxyphenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
CID 71809931
2-thiophen-2-yl-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
CID 71809924
3-phenyl-N-[(2-thiophen-3-ylphenyl)methyl]propanamide
CID 90596831
5-bromo-N-[(2-thiophen-3-ylphenyl)methyl]furan-2-carboxamide
CID 90597008
1-(2-chlorophenyl)-3-[(2-thiophen-3-ylphenyl)methyl]urea
CID 71809975
N-[(2-thiophen-3-ylphenyl)methyl]undecanamide
CID 90596958
N-[(2-thiophen-3-ylphenyl)methyl]prop-2-ynamide
CID 90596997
2,4,6-trimethyl-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 90596839
2-(4-chlorophenyl)-N-[(2-thiophen-3-yl-4-pyridinyl)methyl]acetamide
CID 121165718
4-(4-fluorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 90596881
2-[(2-fluorophenyl)sulfonylamino]-N-[(2-thiophen-3-ylphenyl)methyl]acetamide
CID 90596889
2-ethoxy-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 90596843

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide (CID 90596848) is 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide is O=C(Cc1ccc(Cl)cc1)NCc1ccccc1-c1ccsc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide?
The InChIKey is NWZNFSZUEBZGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNOS/c20-17-7-5-14(6-8-17)11-19(22)21-12-15-3-1-2-4-18(15)16-9-10-23-13-16/h1-10,13H,11-12H2,(H,21,22).
What are the key properties of 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide?
2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide has a molecular weight of 341.86 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[(2-thiophen-3-ylphenyl)methyl]acetamide is sourced from PubChem (CID 90596848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).