[2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine

C16H25NO2 — CID 43294234

IUPAC[2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine
SMILESCOCCc1ccc(OC2CCCCC2CN)cc1
InChIInChI=1S/C16H25NO2/c1-18-11-10-13-6-8-15(9-7-13)19-16-5-3-2-4-14(16)12-17/h6-9,14,16H,2-5,10-12,17H2,1H3
InChIKeyXHNGBFDXYDDRMP-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.77
Rot. Bonds6

About [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine

[2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine (PubChem CID 43294234) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine
PubChem CID43294234
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name[2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine
SMILESCOCCc1ccc(OC2CCCCC2CN)cc1
InChIInChI=1S/C16H25NO2/c1-18-11-10-13-6-8-15(9-7-13)19-16-5-3-2-4-14(16)12-17/h6-9,14,16H,2-5,10-12,17H2,1H3
InChIKeyXHNGBFDXYDDRMP-UHFFFAOYSA-N
XLogP2.77
TPSA44.48 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 ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[4-(2-methoxyethyl)phenoxy]cyclopentyl]methanamine
CID 43294230
[2-(4-methylphenoxy)cyclopentyl]methanamine
CID 43294044
methyl 4-[2-(aminomethyl)cyclohexyl]oxybenzoate
CID 117053537
[2-[4-(2-methylbutan-2-yl)phenoxy]cyclohexyl]methanamine
CID 43293934
4-[2-(aminomethyl)cyclohexyl]oxybenzoic acid
CID 117053471
5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine
CID 79857865
[2-[2-(4-methoxyphenyl)ethyl]cycloheptyl]methanamine
CID 81010620
1-ethyl-4-(2-ethylcyclohexyl)oxybenzene
CID 64764923
2-[4-(2-aminoethyl)phenoxy]cyclohexan-1-ol
CID 106940161
[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclopentyl]methanamine
CID 82239829
1-cyclohexyl-2-[4-(2-methoxyethyl)phenoxy]ethanamine
CID 104749060
2-[4-(2-aminoethyl)phenoxy]cycloheptan-1-ol
CID 106940170

Frequently Asked Questions

What is the IUPAC name of [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine?
The IUPAC name of [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine (CID 43294234) is [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine.
What is the SMILES notation for [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine?
The canonical SMILES for [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine is COCCc1ccc(OC2CCCCC2CN)cc1.
What is the InChIKey of [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine?
The InChIKey is XHNGBFDXYDDRMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-18-11-10-13-6-8-15(9-7-13)19-16-5-3-2-4-14(16)12-17/h6-9,14,16H,2-5,10-12,17H2,1H3.
What are the key properties of [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine?
[2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine has a molecular weight of 263.38 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine is sourced from PubChem (CID 43294234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).