[4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine

C18H29NO2 — CID 65052647

IUPAC[4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine
SMILESCCC1CCC(CN)(OCc2cc(C)ccc2OC)CC1
InChIInChI=1S/C18H29NO2/c1-4-15-7-9-18(13-19,10-8-15)21-12-16-11-14(2)5-6-17(16)20-3/h5-6,11,15H,4,7-10,12-13,19H2,1-3H3
InChIKeyOTKRUJWIIAEIBX-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.82
Rot. Bonds6

About [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine

[4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine (PubChem CID 65052647) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine
PubChem CID65052647
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name[4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine
SMILESCCC1CCC(CN)(OCc2cc(C)ccc2OC)CC1
InChIInChI=1S/C18H29NO2/c1-4-15-7-9-18(13-19,10-8-15)21-12-16-11-14(2)5-6-17(16)20-3/h5-6,11,15H,4,7-10,12-13,19H2,1-3H3
InChIKeyOTKRUJWIIAEIBX-UHFFFAOYSA-N
XLogP3.82
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine with MolForge

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Related Compounds

[4-ethyl-1-[(4-ethylphenyl)methoxy]cyclohexyl]methanamine
CID 65052704
[1-[(2-methoxy-5-methylphenyl)methyl]-4-propylcyclohexyl]methanamine
CID 65423317
4-[(2-methoxy-5-methylphenyl)methoxymethyl]piperidine
CID 55060565
4-ethyl-2-[(2-methoxy-5-methylphenyl)methyl]cyclohexan-1-amine
CID 55041701
[4-ethyl-1-[(2-methoxyphenyl)methyl]cyclohexyl]methanamine
CID 65394529
1-[[(2-methoxy-5-methylphenyl)methylamino]methyl]-4-methylcyclohexan-1-ol
CID 65115646
1-[[(5-chloro-2-methoxyphenyl)methylamino]methyl]-4-ethylcyclohexan-1-ol
CID 65116363
N-[(1-cyclopropylcyclopropyl)methyl]-1-(2-methoxy-5-methylphenyl)methanamine
CID 103838733
4-[[(2-methoxy-5-methylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 106126443
4-ethyl-2-[(2-methoxy-5-methylphenyl)methyl]cyclohexan-1-ol
CID 62161726
4-[(2-methoxy-5-methylphenyl)methoxy]piperidine
CID 62159793
1-(4,4-dimethylcyclohexyl)-2-(2-methoxy-5-methylphenyl)ethanone
CID 65391197

Frequently Asked Questions

What is the IUPAC name of [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine?
The IUPAC name of [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine (CID 65052647) is [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine.
What is the SMILES notation for [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine?
The canonical SMILES for [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine is CCC1CCC(CN)(OCc2cc(C)ccc2OC)CC1.
What is the InChIKey of [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine?
The InChIKey is OTKRUJWIIAEIBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-4-15-7-9-18(13-19,10-8-15)21-12-16-11-14(2)5-6-17(16)20-3/h5-6,11,15H,4,7-10,12-13,19H2,1-3H3.
What are the key properties of [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine?
[4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine has a molecular weight of 291.44 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-1-[(2-methoxy-5-methylphenyl)methoxy]cyclohexyl]methanamine is sourced from PubChem (CID 65052647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).