2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide

C15H22N2O — CID 16793266

IUPAC2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)Cc1ccccc1N)C1CCCCC1
InChIInChI=1S/C15H22N2O/c1-17(13-8-3-2-4-9-13)15(18)11-12-7-5-6-10-14(12)16/h5-7,10,13H,2-4,8-9,11,16H2,1H3
InChIKeyASIVTDAFJRDQQE-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.60
Rot. Bonds3

About 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide

2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide (PubChem CID 16793266) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide
PubChem CID16793266
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)Cc1ccccc1N)C1CCCCC1
InChIInChI=1S/C15H22N2O/c1-17(13-8-3-2-4-9-13)15(18)11-12-7-5-6-10-14(12)16/h5-7,10,13H,2-4,8-9,11,16H2,1H3
InChIKeyASIVTDAFJRDQQE-UHFFFAOYSA-N
XLogP2.60
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(2-aminophenyl)-N-cycloheptyl-N-methylpropanamide;hydrochloride
CID 120608410
2-(2-chlorophenyl)-N-cyclopentyl-N-methylacetamide
CID 166712612
2-[(2-aminophenyl)methyl-cyclopropylamino]-N-cyclopropyl-N-methylacetamide
CID 61489153
2-[[cyclopentyl(methyl)amino]methyl]aniline
CID 43266778
3-(2-aminophenyl)-N-methyl-N-(4-methylcyclohexyl)propanamide;hydrochloride
CID 120608242
2-(2-aminophenyl)-N,N-dimethylacetamide;hydrochloride
CID 141352115
2-(4-aminophenyl)-N-cyclobutyl-N-methylacetamide
CID 115739567
3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide
CID 43541570
2-(2-aminophenyl)-N-(1-cyclopropylethyl)-N-methylacetamide
CID 43568611
2-(5-amino-2-pyridinyl)-N-cyclohexyl-N-methylacetamide
CID 107337433
2-amino-N-cyclobutyl-N-methylbenzamide
CID 115747527
2-(2-aminophenyl)-N-methyl-N-(oxolan-2-ylmethyl)acetamide
CID 61430866

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide?
The IUPAC name of 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide (CID 16793266) is 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide is CN(C(=O)Cc1ccccc1N)C1CCCCC1.
What is the InChIKey of 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide?
The InChIKey is ASIVTDAFJRDQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-17(13-8-3-2-4-9-13)15(18)11-12-7-5-6-10-14(12)16/h5-7,10,13H,2-4,8-9,11,16H2,1H3.
What are the key properties of 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide?
2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide has a molecular weight of 246.35 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide is sourced from PubChem (CID 16793266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).