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

C16H24N2O3 — CID 18070790

IUPACN-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide
SMILESCOc1cc(N)ccc1NC(=O)COC1CCC(C)CC1
InChIInChI=1S/C16H24N2O3/c1-11-3-6-13(7-4-11)21-10-16(19)18-14-8-5-12(17)9-15(14)20-2/h5,8-9,11,13H,3-4,6-7,10,17H2,1-2H3,(H,18,19)
InChIKeyPHUDDXKNHVOLLU-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.81
Rot. Bonds5

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

N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide (PubChem CID 18070790) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide.

Molecular Properties

Compound NameN-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide
PubChem CID18070790
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide
SMILESCOc1cc(N)ccc1NC(=O)COC1CCC(C)CC1
InChIInChI=1S/C16H24N2O3/c1-11-3-6-13(7-4-11)21-10-16(19)18-14-8-5-12(17)9-15(14)20-2/h5,8-9,11,13H,3-4,6-7,10,17H2,1-2H3,(H,18,19)
InChIKeyPHUDDXKNHVOLLU-UHFFFAOYSA-N
XLogP2.81
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-methylphenyl)-2-(4-methylcyclohexyl)oxyacetamide
CID 43376622
N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide
CID 61286331
N-(4-amino-2-chlorophenyl)-2-(3,4-dimethylcyclohexyl)oxyacetamide
CID 64745115
N-(4-amino-2-methoxyphenyl)nonanamide
CID 65447968
N-(4-amino-2-methoxyphenyl)-2-(3-methylpyrrolidin-1-yl)acetamide
CID 61223798
N-(4-amino-2-methoxyphenyl)-2-(oxan-4-ylmethoxy)acetamide
CID 62381831
N-(4-amino-2-methylphenyl)-2-(oxan-4-yloxy)acetamide
CID 61289356
N-(4-amino-2-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)acetamide
CID 18070547
N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 16784173
N-(5-amino-2-fluorophenyl)-2-(4,4-dimethylcyclohexyl)oxyacetamide
CID 114340602
N-(4-amino-2-methoxyphenyl)-4-(oxolan-3-yloxy)butanamide
CID 63557411
N-(4-amino-2-methoxyphenyl)-3-propylsulfinylpropanamide
CID 61304446

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
The IUPAC name of N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide (CID 18070790) is N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide.
What is the SMILES notation for N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
The canonical SMILES for N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide is COc1cc(N)ccc1NC(=O)COC1CCC(C)CC1.
What is the InChIKey of N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
The InChIKey is PHUDDXKNHVOLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11-3-6-13(7-4-11)21-10-16(19)18-14-8-5-12(17)9-15(14)20-2/h5,8-9,11,13H,3-4,6-7,10,17H2,1-2H3,(H,18,19).
What are the key properties of N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide?
N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide has a molecular weight of 292.38 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide is sourced from PubChem (CID 18070790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).