2-(4-cyclohexylphenoxy)ethanamine

C14H21NO — CID 542015

IUPAC2-(4-cyclohexylphenoxy)ethanamine
SMILESNCCOc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C14H21NO/c15-10-11-16-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11,15H2
InChIKeyCRQJNXLEVBZGRP-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.07
Rot. Bonds4

About 2-(4-cyclohexylphenoxy)ethanamine

2-(4-cyclohexylphenoxy)ethanamine (PubChem CID 542015) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(4-cyclohexylphenoxy)ethanamine.

Molecular Properties

Compound Name2-(4-cyclohexylphenoxy)ethanamine
PubChem CID542015
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-(4-cyclohexylphenoxy)ethanamine
SMILESNCCOc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C14H21NO/c15-10-11-16-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11,15H2
InChIKeyCRQJNXLEVBZGRP-UHFFFAOYSA-N
XLogP3.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-piperidin-4-ylphenoxy)ethanamine
CID 115032196
2-(4-cyclohexylphenoxy)ethylazanium
CID 7273660
1-cyclohexyl-4-(2-phenoxyethoxy)benzene
CID 14047825
2-[4-(1-methylpiperidin-4-yl)phenoxy]ethanamine
CID 115040366
1-cyclohexyl-4-heptoxybenzene
CID 56628106
1-(chloromethoxy)-4-cyclohexylbenzene
CID 166607753
4-[2-(4-cyclohexylphenoxy)ethoxy]benzoic acid
CID 22682606
1-cyclohexyl-4-(methoxymethoxy)benzene
CID 143461597
2-[2-(4-cyclohexylphenoxy)ethoxymethyl]oxirane
CID 152663687
2-[4-(2-aminoethoxy)phenoxy]ethanamine;dihydrochloride
CID 46786149
(4-cyclohexylphenyl)methanamine
CID 22246867
4-(2-aminoethoxy)-N-cyclohexylbenzamide
CID 22362508

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclohexylphenoxy)ethanamine?
The IUPAC name of 2-(4-cyclohexylphenoxy)ethanamine (CID 542015) is 2-(4-cyclohexylphenoxy)ethanamine.
What is the SMILES notation for 2-(4-cyclohexylphenoxy)ethanamine?
The canonical SMILES for 2-(4-cyclohexylphenoxy)ethanamine is NCCOc1ccc(C2CCCCC2)cc1.
What is the InChIKey of 2-(4-cyclohexylphenoxy)ethanamine?
The InChIKey is CRQJNXLEVBZGRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c15-10-11-16-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11,15H2.
What are the key properties of 2-(4-cyclohexylphenoxy)ethanamine?
2-(4-cyclohexylphenoxy)ethanamine has a molecular weight of 219.33 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclohexylphenoxy)ethanamine is sourced from PubChem (CID 542015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).