3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine

C17H27NO — CID 64751590

IUPAC3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine
SMILESCC1CC(C)C(Oc2ccccc2C(C)C)C(N)C1
InChIInChI=1S/C17H27NO/c1-11(2)14-7-5-6-8-16(14)19-17-13(4)9-12(3)10-15(17)18/h5-8,11-13,15,17H,9-10,18H2,1-4H3
InChIKeyAKRNRYLOWGCWPY-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.95
Rot. Bonds3

About 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine

3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine (PubChem CID 64751590) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine
PubChem CID64751590
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine
SMILESCC1CC(C)C(Oc2ccccc2C(C)C)C(N)C1
InChIInChI=1S/C17H27NO/c1-11(2)14-7-5-6-8-16(14)19-17-13(4)9-12(3)10-15(17)18/h5-8,11-13,15,17H,9-10,18H2,1-4H3
InChIKeyAKRNRYLOWGCWPY-UHFFFAOYSA-N
XLogP3.95
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-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-(2,4-dimethylphenoxy)-3,5-dimethylcyclohexan-1-amine
CID 64752568
2-(4-tert-butyl-2-methylphenoxy)-3,5-dimethylcyclohexan-1-amine
CID 64751598
3,5-dimethyl-2-(5-methyl-2-propan-2-ylphenoxy)cyclohexan-1-ol
CID 64750729
(1R)-1-[2-(3,5-dimethylcyclohexyl)oxyphenyl]ethanol
CID 78999226
2-(3-tert-butylphenoxy)-3,5-dimethylcyclohexan-1-amine
CID 64751397
3,5-dimethyl-2-(3-methylbutoxy)cyclohexan-1-amine
CID 64752970
(1R)-1-[2-(3,4-dimethylcyclohexyl)oxyphenyl]ethanamine
CID 64744791
3-(2-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79619454
1-(3-methoxycyclohexyl)oxy-2-propan-2-ylbenzene
CID 64764405
[4-ethyl-2-(2-propan-2-ylphenoxy)cyclohexyl]methanamine
CID 43294024
N-ethyl-4-methyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine
CID 63476148
(1S)-1-[2-(3,5-dimethylcyclohexyl)oxyphenyl]propan-1-amine
CID 78999241

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine?
The IUPAC name of 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine (CID 64751590) is 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine?
The canonical SMILES for 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine is CC1CC(C)C(Oc2ccccc2C(C)C)C(N)C1.
What is the InChIKey of 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine?
The InChIKey is AKRNRYLOWGCWPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-11(2)14-7-5-6-8-16(14)19-17-13(4)9-12(3)10-15(17)18/h5-8,11-13,15,17H,9-10,18H2,1-4H3.
What are the key properties of 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine?
3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-(2-propan-2-ylphenoxy)cyclohexan-1-amine is sourced from PubChem (CID 64751590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).