2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine

C16H25NO2 — CID 118042370

IUPAC2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine
SMILESCOc1ccc(C(CN)C2(OC)CCCCC2)cc1
InChIInChI=1S/C16H25NO2/c1-18-14-8-6-13(7-9-14)15(12-17)16(19-2)10-4-3-5-11-16/h6-9,15H,3-5,10-12,17H2,1-2H3
InChIKeyVFDSGKSTTGJKOP-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.09
Rot. Bonds5

About 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine

2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine (PubChem CID 118042370) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine
PubChem CID118042370
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine
SMILESCOc1ccc(C(CN)C2(OC)CCCCC2)cc1
InChIInChI=1S/C16H25NO2/c1-18-14-8-6-13(7-9-14)15(12-17)16(19-2)10-4-3-5-11-16/h6-9,15H,3-5,10-12,17H2,1-2H3
InChIKeyVFDSGKSTTGJKOP-UHFFFAOYSA-N
XLogP3.09
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[[2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethyl]-methylamino]methanol
CID 118042367
[(1-methoxycyclobutyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105270350
2-(1-ethoxycyclohexyl)-2-(4-methoxyphenyl)-N,N-dimethylethanamine
CID 68868814
[3-(1-hydroxycyclohexyl)-3-(4-methoxyphenyl)propyl]-methylazanium chloride
CID 162517103
1-[2-amino-1-[4-(trideuteriomethoxy)phenyl]ethyl]cyclohexan-1-ol;1-[2-[bis(trideuteriomethyl)amino]-1-[4-(trideuteriomethoxy)phenyl]ethyl]cyclohexan-1-ol
CID 157063165
(3,5-dimethoxyphenyl)-(1-methoxycyclopentyl)methanamine
CID 104610743
2-(4-methoxyphenyl)propane-1,3-diamine
CID 20546608
[(1-methoxycycloheptyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105278241
1-[2-dimethylarsanyl-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol;hydrochloride
CID 87689305
bis(1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol);hydrochloride
CID 68818348
N-[(1-methoxycyclobutyl)-(4-methoxyphenyl)methyl]propan-1-amine
CID 116714736
1-[2-amino-2-(4-methoxyphenyl)ethyl]cyclohexan-1-ol
CID 57165649

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine?
The IUPAC name of 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine (CID 118042370) is 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine.
What is the SMILES notation for 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine?
The canonical SMILES for 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine is COc1ccc(C(CN)C2(OC)CCCCC2)cc1.
What is the InChIKey of 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine?
The InChIKey is VFDSGKSTTGJKOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-18-14-8-6-13(7-9-14)15(12-17)16(19-2)10-4-3-5-11-16/h6-9,15H,3-5,10-12,17H2,1-2H3.
What are the key properties of 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine?
2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine has a molecular weight of 263.38 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclohexyl)-2-(4-methoxyphenyl)ethanamine is sourced from PubChem (CID 118042370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).