[1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine

C14H18F3NO2 — CID 65051034

IUPAC[1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine
SMILESNCC1(OCc2ccc(OC(F)(F)F)cc2)CCCC1
InChIInChI=1S/C14H18F3NO2/c15-14(16,17)20-12-5-3-11(4-6-12)9-19-13(10-18)7-1-2-8-13/h3-6H,1-2,7-10,18H2
InChIKeySFMISRHWRGYXAX-UHFFFAOYSA-N
MW289.30 g/mol
LogP3.37
Rot. Bonds5

About [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine

[1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine (PubChem CID 65051034) has the molecular formula C14H18F3NO2 and a molecular weight of 289.30 g/mol. Its IUPAC name is [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine
PubChem CID65051034
Molecular FormulaC14H18F3NO2
Molecular Weight289.30 g/mol
Exact Mass289.13
IUPAC Name[1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine
SMILESNCC1(OCc2ccc(OC(F)(F)F)cc2)CCCC1
InChIInChI=1S/C14H18F3NO2/c15-14(16,17)20-12-5-3-11(4-6-12)9-19-13(10-18)7-1-2-8-13/h3-6H,1-2,7-10,18H2
InChIKeySFMISRHWRGYXAX-UHFFFAOYSA-N
XLogP3.37
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.30
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(4-bromophenyl)methoxy]cycloheptyl]methanamine
CID 82832273
1-(aminomethyl)-N-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]cyclopentan-1-amine
CID 62010342
[4-methyl-1-[[4-(trifluoromethyl)phenyl]methoxy]cyclohexyl]methanamine
CID 65050673
1-(1-methoxycyclobutyl)-3-[4-(trifluoromethoxy)phenyl]propan-2-ol
CID 103560075
[1-(4-ethylphenoxy)cyclohexyl]methanamine
CID 82129126
2-methyl-2-[[4-(trifluoromethoxy)phenyl]methoxy]propan-1-amine
CID 65053013
1-amino-N-[[4-(trifluoromethoxy)phenyl]methyl]cyclohexane-1-carboxamide
CID 119276278
[1-(aminomethyl)cyclohexyl]-[4-(trifluoromethoxy)phenyl]methanol
CID 79124132
1-(1-ethylcyclopentyl)-2-[4-(trifluoromethoxy)phenyl]ethanamine
CID 115843446
1-[4-(trifluoromethoxy)phenyl]cyclobutan-1-amine;hydrochloride
CID 129032986
[4-ethyl-1-[(4-ethylphenyl)methoxy]cyclohexyl]methanamine
CID 65052704
1-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]cyclohexan-1-amine
CID 63454373

Frequently Asked Questions

What is the IUPAC name of [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine?
The IUPAC name of [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine (CID 65051034) is [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine.
What is the SMILES notation for [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine?
The canonical SMILES for [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine is NCC1(OCc2ccc(OC(F)(F)F)cc2)CCCC1.
What is the InChIKey of [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine?
The InChIKey is SFMISRHWRGYXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F3NO2/c15-14(16,17)20-12-5-3-11(4-6-12)9-19-13(10-18)7-1-2-8-13/h3-6H,1-2,7-10,18H2.
What are the key properties of [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine?
[1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine has a molecular weight of 289.30 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[4-(trifluoromethoxy)phenyl]methoxy]cyclopentyl]methanamine is sourced from PubChem (CID 65051034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).