2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine

C14H21NO2 — CID 16788224

IUPAC2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine
SMILESCOc1cccc(OC2CC(C)CCC2N)c1
InChIInChI=1S/C14H21NO2/c1-10-6-7-13(15)14(8-10)17-12-5-3-4-11(9-12)16-2/h3-5,9-10,13-14H,6-8,15H2,1-2H3
InChIKeyZILKNQBICFYTDX-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.59
Rot. Bonds3

About 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine

2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine (PubChem CID 16788224) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine
PubChem CID16788224
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine
SMILESCOc1cccc(OC2CC(C)CCC2N)c1
InChIInChI=1S/C14H21NO2/c1-10-6-7-13(15)14(8-10)17-12-5-3-4-11(9-12)16-2/h3-5,9-10,13-14H,6-8,15H2,1-2H3
InChIKeyZILKNQBICFYTDX-UHFFFAOYSA-N
XLogP2.59
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(3-methoxyphenoxy)-4-methylcyclohexyl]methanamine
CID 43293897
2-(3-methoxyphenoxy)cyclopentan-1-amine
CID 16796159
4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclohexan-1-amine
CID 61398789
2-(3,5-difluorophenoxy)-4-methylcyclohexan-1-amine
CID 62783742
[2-(3-tert-butylphenoxy)-4-methylcyclohexyl]methanamine
CID 43294223
3-(3-methoxyphenoxy)cyclobutan-1-amine
CID 66356689
[4-methyl-2-[3-(trifluoromethyl)phenoxy]cyclohexyl]methanamine
CID 43294072
2-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-5-methylcyclohexan-1-amine
CID 64765538
2-(4-methoxyphenoxy)cyclopropan-1-amine
CID 119092360
3-(5-methyl-2-propan-2-ylcyclohexyl)oxyaniline
CID 80752408
4-tert-butyl-2-(3-propan-2-ylphenoxy)cyclohexan-1-amine
CID 43097367
2-(3,5-dimethoxyphenoxy)cycloheptan-1-amine
CID 43589856

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine?
The IUPAC name of 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine (CID 16788224) is 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine.
What is the SMILES notation for 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine?
The canonical SMILES for 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine is COc1cccc(OC2CC(C)CCC2N)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine?
The InChIKey is ZILKNQBICFYTDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10-6-7-13(15)14(8-10)17-12-5-3-4-11(9-12)16-2/h3-5,9-10,13-14H,6-8,15H2,1-2H3.
What are the key properties of 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine?
2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine has a molecular weight of 235.33 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenoxy)-4-methylcyclohexan-1-amine is sourced from PubChem (CID 16788224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).