N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide

C16H24N2O2 — CID 43376622

IUPACN-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide
SMILESCc1ccc(NC(=O)COC2CCC(C)CC2)c(N)c1
InChIInChI=1S/C16H24N2O2/c1-11-3-6-13(7-4-11)20-10-16(19)18-15-8-5-12(2)9-14(15)17/h5,8-9,11,13H,3-4,6-7,10,17H2,1-2H3,(H,18,19)
InChIKeyXUYSDFBXIZDGGR-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.11
Rot. Bonds4

About N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide

N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide (PubChem CID 43376622) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide.

Molecular Properties

Compound NameN-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide
PubChem CID43376622
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide
SMILESCc1ccc(NC(=O)COC2CCC(C)CC2)c(N)c1
InChIInChI=1S/C16H24N2O2/c1-11-3-6-13(7-4-11)20-10-16(19)18-15-8-5-12(2)9-14(15)17/h5,8-9,11,13H,3-4,6-7,10,17H2,1-2H3,(H,18,19)
InChIKeyXUYSDFBXIZDGGR-UHFFFAOYSA-N
XLogP3.11
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
The IUPAC name of N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide (CID 43376622) is N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide.
What is the SMILES notation for N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
The canonical SMILES for N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide is Cc1ccc(NC(=O)COC2CCC(C)CC2)c(N)c1.
What is the InChIKey of N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
The InChIKey is XUYSDFBXIZDGGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11-3-6-13(7-4-11)20-10-16(19)18-15-8-5-12(2)9-14(15)17/h5,8-9,11,13H,3-4,6-7,10,17H2,1-2H3,(H,18,19).
What are the key properties of N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide has a molecular weight of 276.38 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide is sourced from PubChem (CID 43376622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).