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

C16H24N2OS — CID 106312954

IUPAC2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide
SMILESCSC1CCC(NC(=O)C(N)c2ccc(C)cc2)CC1
InChIInChI=1S/C16H24N2OS/c1-11-3-5-12(6-4-11)15(17)16(19)18-13-7-9-14(20-2)10-8-13/h3-6,13-15H,7-10,17H2,1-2H3,(H,18,19)
InChIKeyDZIUGKXUXHLIOX-UHFFFAOYSA-N
MW292.45 g/mol
LogP2.79
Rot. Bonds4

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

2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide (PubChem CID 106312954) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide
PubChem CID106312954
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide
SMILESCSC1CCC(NC(=O)C(N)c2ccc(C)cc2)CC1
InChIInChI=1S/C16H24N2OS/c1-11-3-5-12(6-4-11)15(17)16(19)18-13-7-9-14(20-2)10-8-13/h3-6,13-15H,7-10,17H2,1-2H3,(H,18,19)
InChIKeyDZIUGKXUXHLIOX-UHFFFAOYSA-N
XLogP2.79
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(4-methylcyclohexyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668364
(2R)-2-amino-N-(3-methylsulfanylcyclopentyl)-2-phenylacetamide
CID 103797785
2-amino-N-(4,4-dimethylcyclohexyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668551
3-[[2-amino-2-(4-methylphenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 103869698
2-amino-N-(1-cyclopropylpiperidin-4-yl)-2-(4-methylphenyl)acetamide
CID 106151639
2-amino-N-(1-cyclopropylpiperidin-4-yl)-2-(4-methylphenyl)acetamide;dihydrochloride
CID 120669508
2-amino-N-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 83533215
4-[[2-amino-2-(4-methylphenyl)acetyl]amino]-N-cyclopropylbutanamide
CID 106151335
2-amino-2-(4-methylphenyl)-N-(1-phenylpiperidin-4-yl)acetamide
CID 120669904
2-amino-N-(1-cyclopropylsulfonylpiperidin-4-yl)-2-(4-methylphenyl)acetamide
CID 120669080
2-amino-N-(3-methylcyclohexyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667211
2-amino-2-(4-methylphenyl)-N-(1-propylpiperidin-4-yl)acetamide;dihydrochloride
CID 120669407

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide?
The IUPAC name of 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide (CID 106312954) is 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide.
What is the SMILES notation for 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide?
The canonical SMILES for 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide is CSC1CCC(NC(=O)C(N)c2ccc(C)cc2)CC1.
What is the InChIKey of 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide?
The InChIKey is DZIUGKXUXHLIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-11-3-5-12(6-4-11)15(17)16(19)18-13-7-9-14(20-2)10-8-13/h3-6,13-15H,7-10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide?
2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide has a molecular weight of 292.45 g/mol, XLogP of 2.79, 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-(4-methylsulfanylcyclohexyl)acetamide is sourced from PubChem (CID 106312954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).