[2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine

C15H22FNO2 — CID 102877277

IUPAC[2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine
SMILESCOc1ccc(COC2CCCCC2CN)c(F)c1
InChIInChI=1S/C15H22FNO2/c1-18-13-7-6-12(14(16)8-13)10-19-15-5-3-2-4-11(15)9-17/h6-8,11,15H,2-5,9-10,17H2,1H3
InChIKeyIRUQWVWWTWVZEO-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.87
Rot. Bonds5

About [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine

[2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine (PubChem CID 102877277) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine
PubChem CID102877277
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name[2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine
SMILESCOc1ccc(COC2CCCCC2CN)c(F)c1
InChIInChI=1S/C15H22FNO2/c1-18-13-7-6-12(14(16)8-13)10-19-15-5-3-2-4-11(15)9-17/h6-8,11,15H,2-5,9-10,17H2,1H3
InChIKeyIRUQWVWWTWVZEO-UHFFFAOYSA-N
XLogP2.87
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine
CID 43329442
[2-[(3-methoxyphenyl)methoxy]cyclopentyl]methanamine
CID 43428902
4-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexan-1-amine
CID 102876123
2-(aminomethyl)-N-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclopentan-1-amine
CID 102877791
[2-(aminomethyl)cyclohexyl]-(2-fluoro-4-methoxyphenyl)methanone
CID 103397138
[2-[(4-chloro-3-fluorophenyl)methoxy]cyclohexyl]methanamine
CID 107882768
4-[(2-ethylcyclohexyl)oxymethyl]-3-fluorobenzoic acid
CID 63073948
2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine
CID 102876314
2-fluoro-1-[(4-iodophenoxy)methyl]-4-methoxybenzene
CID 102876837
[2-[(2-fluoro-3-nitrophenyl)methoxy]cyclopentyl]methanamine
CID 107349967
2-cyclopentyloxy-N-[(2-fluoro-4-methoxyphenyl)methyl]ethanamine
CID 102876414
5-(2-fluoro-4-methoxyphenyl)pentan-1-amine
CID 65305702

Frequently Asked Questions

What is the IUPAC name of [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine?
The IUPAC name of [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine (CID 102877277) is [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine.
What is the SMILES notation for [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine?
The canonical SMILES for [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine is COc1ccc(COC2CCCCC2CN)c(F)c1.
What is the InChIKey of [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine?
The InChIKey is IRUQWVWWTWVZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-18-13-7-6-12(14(16)8-13)10-19-15-5-3-2-4-11(15)9-17/h6-8,11,15H,2-5,9-10,17H2,1H3.
What are the key properties of [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine?
[2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine has a molecular weight of 267.34 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-fluoro-4-methoxyphenyl)methoxy]cyclohexyl]methanamine is sourced from PubChem (CID 102877277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).