2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide

C15H14ClNOS — CID 66938308

IUPAC2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide
SMILESNC(=O)CSCc1ccccc1-c1ccc(Cl)cc1
InChIInChI=1S/C15H14ClNOS/c16-13-7-5-11(6-8-13)14-4-2-1-3-12(14)9-19-10-15(17)18/h1-8H,9-10H2,(H2,17,18)
InChIKeyZPYVUYMNKSXIEF-UHFFFAOYSA-N
MW291.80 g/mol
LogP3.73
Rot. Bonds5

About 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide

2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide (PubChem CID 66938308) has the molecular formula C15H14ClNOS and a molecular weight of 291.80 g/mol. Its IUPAC name is 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide.

Molecular Properties

Compound Name2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide
PubChem CID66938308
Molecular FormulaC15H14ClNOS
Molecular Weight291.80 g/mol
Exact Mass291.05
IUPAC Name2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide
SMILESNC(=O)CSCc1ccccc1-c1ccc(Cl)cc1
InChIInChI=1S/C15H14ClNOS/c16-13-7-5-11(6-8-13)14-4-2-1-3-12(14)9-19-10-15(17)18/h1-8H,9-10H2,(H2,17,18)
InChIKeyZPYVUYMNKSXIEF-UHFFFAOYSA-N
XLogP3.73
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.80
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2-chlorophenyl)methylsulfanyl]acetamide
CID 958774
2-[(2-iodophenyl)methylsulfanyl]acetamide
CID 23089127
2-[(2-amino-2-oxoethyl)sulfanylmethyl]benzoic acid
CID 82177510
2-[[2-(3-chloro-4-fluorophenoxy)phenyl]methylsulfanyl]acetamide
CID 66573934
bis[(2-phenylphenyl)methylsulfanyl]methanone
CID 87227183
2-[1-[4-(2-chlorophenyl)phenyl]ethylsulfanyl]acetamide
CID 54454820
1-[[2-(4-chlorophenyl)phenyl]methyl]-3-(2-hydroxyethyl)urea
CID 110923275
N-[[2-(4-chlorophenyl)phenyl]methyl]ethanamine
CID 54911635
2-[[2-(phenoxymethyl)phenyl]methylsulfanyl]acetamide
CID 86077179
4-[[2-(4-chlorophenyl)phenyl]methylamino]pyridine-3-carboxamide
CID 133469856
2-[2-[(4-chlorophenyl)methylsulfanylmethyl]phenyl]acetic acid
CID 114790026
4-amino-N-[[2-(4-chlorophenyl)phenyl]methyl]pentanamide
CID 120562027

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide?
The IUPAC name of 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide (CID 66938308) is 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide.
What is the SMILES notation for 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide?
The canonical SMILES for 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide is NC(=O)CSCc1ccccc1-c1ccc(Cl)cc1.
What is the InChIKey of 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide?
The InChIKey is ZPYVUYMNKSXIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNOS/c16-13-7-5-11(6-8-13)14-4-2-1-3-12(14)9-19-10-15(17)18/h1-8H,9-10H2,(H2,17,18).
What are the key properties of 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide?
2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide has a molecular weight of 291.80 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-chlorophenyl)phenyl]methylsulfanyl]acetamide is sourced from PubChem (CID 66938308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).