N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide

C17H19NOS — CID 734052

IUPACN-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide
SMILESCc1ccc(SCC(=O)Nc2ccc(C)cc2C)cc1
InChIInChI=1S/C17H19NOS/c1-12-4-7-15(8-5-12)20-11-17(19)18-16-9-6-13(2)10-14(16)3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyWVZCTYGNCBYMOQ-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.34
Rot. Bonds4

About N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide

N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide (PubChem CID 734052) has the molecular formula C17H19NOS and a molecular weight of 285.41 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide
PubChem CID734052
Molecular FormulaC17H19NOS
Molecular Weight285.41 g/mol
Exact Mass285.12
IUPAC NameN-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide
SMILESCc1ccc(SCC(=O)Nc2ccc(C)cc2C)cc1
InChIInChI=1S/C17H19NOS/c1-12-4-7-15(8-5-12)20-11-17(19)18-16-9-6-13(2)10-14(16)3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyWVZCTYGNCBYMOQ-UHFFFAOYSA-N
XLogP4.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-2-methylphenyl)-2-(4-methylphenyl)sulfanylacetamide
CID 16528206
N-(2,4-dimethylphenyl)-2-(2,5-dimethylphenyl)sulfanylacetamide
CID 24679630
N-(2,4-dimethylphenyl)-2-(3-methoxyphenyl)sulfanylacetamide
CID 35040719
N-[4-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanylphenyl]-2-fluorobenzamide
CID 22775332
2-(4-hydroxyphenyl)sulfanyl-N-(4-iodo-2-methylphenyl)acetamide
CID 61031719
2-(4-acetylphenyl)sulfanyl-N-(2,5-dimethylphenyl)acetamide
CID 94780327
N-(2-hydroxy-4-methylphenyl)-2-phenylsulfanylacetamide
CID 6460145
2-(4-bromophenyl)sulfanyl-N-(4-fluoro-2-methylphenyl)acetamide
CID 7924484
N-(2,4-dimethylphenyl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanylacetamide
CID 22779734
2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5-methylbenzoic acid
CID 4188338
N-(4-amino-2-methylphenyl)-2-(3-methylphenyl)sulfanylacetamide
CID 61244892
2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(2,4-dimethylphenyl)acetamide
CID 6411915

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide (CID 734052) is N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide is Cc1ccc(SCC(=O)Nc2ccc(C)cc2C)cc1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide?
The InChIKey is WVZCTYGNCBYMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NOS/c1-12-4-7-15(8-5-12)20-11-17(19)18-16-9-6-13(2)10-14(16)3/h4-10H,11H2,1-3H3,(H,18,19).
What are the key properties of N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide?
N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide has a molecular weight of 285.41 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-(4-methylphenyl)sulfanylacetamide is sourced from PubChem (CID 734052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).