[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine

C15H23NO2 — CID 43329442

IUPAC[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine
SMILESCOc1cccc(COC2CCCCC2CN)c1
InChIInChI=1S/C15H23NO2/c1-17-14-7-4-5-12(9-14)11-18-15-8-3-2-6-13(15)10-16/h4-5,7,9,13,15H,2-3,6,8,10-11,16H2,1H3
InChIKeyLRNXPKDMEKTXCB-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.73
Rot. Bonds5

About [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine

[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine (PubChem CID 43329442) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine
PubChem CID43329442
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine
SMILESCOc1cccc(COC2CCCCC2CN)c1
InChIInChI=1S/C15H23NO2/c1-17-14-7-4-5-12(9-14)11-18-15-8-3-2-6-13(15)10-16/h4-5,7,9,13,15H,2-3,6,8,10-11,16H2,1H3
InChIKeyLRNXPKDMEKTXCB-UHFFFAOYSA-N
XLogP2.73
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(3-methoxyphenyl)methoxy]cyclopentyl]methanamine
CID 43428902
2-[(3-methoxyphenyl)methoxy]cyclohexan-1-amine
CID 55036871
2-[(3-methoxyphenyl)methoxy]cycloheptan-1-amine
CID 62110928
1-[2-(aminomethyl)cyclohexyl]-2-(3-methoxyphenyl)ethanone
CID 116584559
1-methoxy-3-[[(1R)-2-propan-2-ylcyclopentyl]oxymethyl]benzene
CID 59459056
[2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine
CID 102877277
2-methoxy-3-[(3-methoxyphenyl)methoxy]cyclobutan-1-amine
CID 113439770
2-[(3-methoxyphenyl)methoxy]-N-propylcyclohexan-1-amine
CID 62111265
[2-[(3-methoxyphenyl)methyl]cyclobutyl]methanamine
CID 81011141
[3-[2-(aminomethyl)cyclohexyl]oxyphenyl]methanol
CID 115002126
2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine
CID 61419887
[2-(3-methoxyphenyl)cyclohexyl]methanamine
CID 10443420

Frequently Asked Questions

What is the IUPAC name of [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine?
The IUPAC name of [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine (CID 43329442) is [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine.
What is the SMILES notation for [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine?
The canonical SMILES for [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine is COc1cccc(COC2CCCCC2CN)c1.
What is the InChIKey of [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine?
The InChIKey is LRNXPKDMEKTXCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-17-14-7-4-5-12(9-14)11-18-15-8-3-2-6-13(15)10-16/h4-5,7,9,13,15H,2-3,6,8,10-11,16H2,1H3.
What are the key properties of [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine?
[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine has a molecular weight of 249.35 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine is sourced from PubChem (CID 43329442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).