3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine

C16H25NO2 — CID 79618027

IUPAC3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine
SMILESCCNC1CCCC(Oc2cccc(OCC)c2)C1
InChIInChI=1S/C16H25NO2/c1-3-17-13-7-5-9-15(11-13)19-16-10-6-8-14(12-16)18-4-2/h6,8,10,12-13,15,17H,3-5,7,9,11H2,1-2H3
InChIKeyJTWTZNFEZOBVEV-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.38
Rot. Bonds6

About 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine

3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine (PubChem CID 79618027) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine.

Molecular Properties

Compound Name3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine
PubChem CID79618027
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine
SMILESCCNC1CCCC(Oc2cccc(OCC)c2)C1
InChIInChI=1S/C16H25NO2/c1-3-17-13-7-5-9-15(11-13)19-16-10-6-8-14(12-16)18-4-2/h6,8,10,12-13,15,17H,3-5,7,9,11H2,1-2H3
InChIKeyJTWTZNFEZOBVEV-UHFFFAOYSA-N
XLogP3.38
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-ethoxyphenoxy)-N-ethylcyclopentan-1-amine
CID 79632753
3-(3-ethoxyphenoxy)-N-methylcyclopentan-1-amine
CID 79632551
N-ethyl-3-(2-propan-2-ylphenoxy)cyclohexan-1-amine
CID 79618563
3-(2-chlorophenoxy)-N-ethylcyclohexan-1-amine
CID 79618026
N-[2-(3-ethoxyphenoxy)propyl]cyclohexanamine
CID 62584741
3-(4-cyclopropyloxyphenyl)-N-ethylcycloheptan-1-amine
CID 114520158
3-(3-tert-butylphenoxy)-N-methylcyclohexan-1-amine
CID 79618131
3-ethoxy-N-ethylcyclohexan-1-amine
CID 79619303
N-methyl-3-phenoxycyclohexan-1-amine
CID 79618884
3-(3-ethoxyphenoxy)cyclopentan-1-one
CID 79643582
3-(3-ethoxyphenoxy)-1-(ethylamino)cyclopentane-1-carbonitrile
CID 79650285
3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine
CID 79619329

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine?
The IUPAC name of 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine (CID 79618027) is 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine.
What is the SMILES notation for 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine?
The canonical SMILES for 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine is CCNC1CCCC(Oc2cccc(OCC)c2)C1.
What is the InChIKey of 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine?
The InChIKey is JTWTZNFEZOBVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-3-17-13-7-5-9-15(11-13)19-16-10-6-8-14(12-16)18-4-2/h6,8,10,12-13,15,17H,3-5,7,9,11H2,1-2H3.
What are the key properties of 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine?
3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethoxyphenoxy)-N-ethylcyclohexan-1-amine is sourced from PubChem (CID 79618027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).