2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide

C18H28N2O — CID 106312536

IUPAC2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)N(C)C2CCC(C)(C)CC2)cc1
InChIInChI=1S/C18H28N2O/c1-13-5-7-14(8-6-13)16(19)17(21)20(4)15-9-11-18(2,3)12-10-15/h5-8,15-16H,9-12,19H2,1-4H3
InChIKeyKTUOABBXILBZRY-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.42
Rot. Bonds3

About 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide

2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide (PubChem CID 106312536) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide
PubChem CID106312536
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)N(C)C2CCC(C)(C)CC2)cc1
InChIInChI=1S/C18H28N2O/c1-13-5-7-14(8-6-13)16(19)17(21)20(4)15-9-11-18(2,3)12-10-15/h5-8,15-16H,9-12,19H2,1-4H3
InChIKeyKTUOABBXILBZRY-UHFFFAOYSA-N
XLogP3.42
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-cyclopentyl-N-methyl-2-(4-methylphenyl)acetamide
CID 106151212
2-amino-N-(4-ethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide
CID 106312221
2-amino-N-methyl-2-(4-methylphenyl)-N-(oxolan-3-yl)acetamide
CID 114172118
2-amino-N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(4-methylphenyl)acetamide;hydrochloride
CID 120666510
2-amino-N-cyclopentyl-N-methyl-2-phenylacetamide
CID 43267220
2-amino-N-(4,4-dimethylcyclohexyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668551
(2S)-2-amino-N-(4,4-dimethylcyclohexyl)-N-methylpropanamide;hydrochloride
CID 119328237
2-[[2-amino-2-(4-methylphenyl)acetyl]-cyclopentylamino]acetic acid
CID 103868808
2-amino-N-cyclopropyl-N-(2-methoxyethyl)-2-(4-methylphenyl)acetamide
CID 106312189
(2R)-2-amino-N-(4,4-dimethylcyclohexyl)-N,3,3-trimethylbutanamide
CID 113353538
2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide
CID 106312192
2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 106151192

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide (CID 106312536) is 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide is Cc1ccc(C(N)C(=O)N(C)C2CCC(C)(C)CC2)cc1.
What is the InChIKey of 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide?
The InChIKey is KTUOABBXILBZRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-13-5-7-14(8-6-13)16(19)17(21)20(4)15-9-11-18(2,3)12-10-15/h5-8,15-16H,9-12,19H2,1-4H3.
What are the key properties of 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide?
2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide has a molecular weight of 288.44 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4,4-dimethylcyclohexyl)-N-methyl-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 106312536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).