2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide

C16H18N2OS — CID 106312111

IUPAC2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide
SMILESCSc1ccccc1NC(=O)C(N)c1ccc(C)cc1
InChIInChI=1S/C16H18N2OS/c1-11-7-9-12(10-8-11)15(17)16(19)18-13-5-3-4-6-14(13)20-2/h3-10,15H,17H2,1-2H3,(H,18,19)
InChIKeyRBRBCESHROFXNV-UHFFFAOYSA-N
MW286.40 g/mol
LogP3.36
Rot. Bonds4

About 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide

2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide (PubChem CID 106312111) has the molecular formula C16H18N2OS and a molecular weight of 286.40 g/mol. Its IUPAC name is 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide
PubChem CID106312111
Molecular FormulaC16H18N2OS
Molecular Weight286.40 g/mol
Exact Mass286.11
IUPAC Name2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide
SMILESCSc1ccccc1NC(=O)C(N)c1ccc(C)cc1
InChIInChI=1S/C16H18N2OS/c1-11-7-9-12(10-8-11)15(17)16(19)18-13-5-3-4-6-14(13)20-2/h3-10,15H,17H2,1-2H3,(H,18,19)
InChIKeyRBRBCESHROFXNV-UHFFFAOYSA-N
XLogP3.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-amino-2-(4-methylphenyl)acetyl]amino]benzoic acid
CID 106312235
2-amino-2-(4-methylphenyl)-N-(2-propylphenyl)acetamide
CID 106312114
2-amino-N-(2-bromo-3-pyridinyl)-2-(4-methylphenyl)acetamide
CID 106312918
2-amino-N-(2-bromo-4-methylphenyl)-2-(4-methylphenyl)acetamide
CID 106312006
3-amino-2-methyl-N-(2-methylsulfanylphenyl)-3-phenylpropanamide
CID 80546722
2-amino-N-(2-chloro-5-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 106312872
2-amino-N-(4-fluoro-2-iodophenyl)-2-(4-methylphenyl)acetamide
CID 106312524
2-amino-N-(5-bromo-4-fluoro-2-methylphenyl)-2-(4-methylphenyl)acetamide
CID 106312877
2-amino-N-(2,3-dimethylphenyl)-2-phenylacetamide
CID 24694954
2-amino-2-(4-methylphenyl)-N-(3-methyl-4-pyridinyl)acetamide
CID 106151710
N-[4-[[2-amino-2-(4-methylphenyl)acetyl]amino]phenyl]-2-methylpropanamide
CID 120666693
2-chloro-N-(2-methylsulfanylphenyl)-2-phenylacetamide
CID 43236531

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide?
The IUPAC name of 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide (CID 106312111) is 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide.
What is the SMILES notation for 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide?
The canonical SMILES for 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide is CSc1ccccc1NC(=O)C(N)c1ccc(C)cc1.
What is the InChIKey of 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide?
The InChIKey is RBRBCESHROFXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS/c1-11-7-9-12(10-8-11)15(17)16(19)18-13-5-3-4-6-14(13)20-2/h3-10,15H,17H2,1-2H3,(H,18,19).
What are the key properties of 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide?
2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide has a molecular weight of 286.40 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 106312111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).