(2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide

C16H24N2O — CID 104897433

IUPAC(2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide
SMILESCC1CCCCC1N(C)C(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-12-8-6-7-11-14(12)18(2)16(19)15(17)13-9-4-3-5-10-13/h3-5,9-10,12,14-15H,6-8,11,17H2,1-2H3/t12?,14?,15-/m0/s1
InChIKeyWGNAMYKBBSHFHV-ZALBZXLWSA-N
MW260.38 g/mol
LogP2.72
Rot. Bonds3

About (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide

(2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide (PubChem CID 104897433) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide
PubChem CID104897433
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name(2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide
SMILESCC1CCCCC1N(C)C(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-12-8-6-7-11-14(12)18(2)16(19)15(17)13-9-4-3-5-10-13/h3-5,9-10,12,14-15H,6-8,11,17H2,1-2H3/t12?,14?,15-/m0/s1
InChIKeyWGNAMYKBBSHFHV-ZALBZXLWSA-N
XLogP2.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 11597698
Melinamide
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Methyl-phe-pro-amino-cyclohexylglycine
CID 448763
cyclo(L-leucyl-L-phenylalanyl)
CID 7076347
N-Cyclohexyl-2-phenylacetamide
CID 82500
(1S)-1-Cyclopropyl-2-[(2S)-4-(2,5-difluorophenyl)-2-phenyl-2,5-dihydro-1H-pyrrol-1-YL]-2-oxoethanamine
CID 6102824
N-cyclohexyl-4-phenylbutanamide
CID 288831
(4-Benzhydrylpiperazin-1-yl)(cyclohexyl)methanone
CID 994313
Leucyl-phenylalanine amide
CID 3082491
N-benzyl-2-cyclohexylacetamide
CID 880904
N-[(2S)-3-methyl-1-oxo-1-(2-phenylethylamino)butan-2-yl]benzamide
CID 2211217
N-(pentan-2-yl)-2-phenylacetamide
CID 2886843

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide?
The IUPAC name of (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide (CID 104897433) is (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide.
What is the SMILES notation for (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide?
The canonical SMILES for (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide is CC1CCCCC1N(C)C(=O)[C@@H](N)c1ccccc1.
What is the InChIKey of (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide?
The InChIKey is WGNAMYKBBSHFHV-ZALBZXLWSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-8-6-7-11-14(12)18(2)16(19)15(17)13-9-4-3-5-10-13/h3-5,9-10,12,14-15H,6-8,11,17H2,1-2H3/t12?,14?,15-/m0/s1.
What are the key properties of (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide?
(2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide has a molecular weight of 260.38 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylacetamide is sourced from PubChem (CID 104897433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).