[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine

C15H22FN — CID 84797654

IUPAC[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine
SMILESCC(C)c1cc(F)cc(C2(CN)CCCC2)c1
InChIInChI=1S/C15H22FN/c1-11(2)12-7-13(9-14(16)8-12)15(10-17)5-3-4-6-15/h7-9,11H,3-6,10,17H2,1-2H3
InChIKeyYWKPHXWIQATNCT-UHFFFAOYSA-N
MW235.35 g/mol
LogP3.72
Rot. Bonds3

About [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine

[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine (PubChem CID 84797654) has the molecular formula C15H22FN and a molecular weight of 235.35 g/mol. Its IUPAC name is [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine
PubChem CID84797654
Molecular FormulaC15H22FN
Molecular Weight235.35 g/mol
Exact Mass235.17
IUPAC Name[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine
SMILESCC(C)c1cc(F)cc(C2(CN)CCCC2)c1
InChIInChI=1S/C15H22FN/c1-11(2)12-7-13(9-14(16)8-12)15(10-17)5-3-4-6-15/h7-9,11H,3-6,10,17H2,1-2H3
InChIKeyYWKPHXWIQATNCT-UHFFFAOYSA-N
XLogP3.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine
CID 84779814
[1-(4-propan-2-ylphenyl)cyclobutyl]methanamine
CID 28937935
[1-(2,3-difluoro-5-propan-2-ylphenyl)cyclobutyl]methanamine
CID 117351296
[1-(3,5-difluoro-4-methylphenyl)cyclohexyl]methanamine
CID 117351218
[1-(3-fluoro-5-methylsulfonylphenyl)cyclobutyl]methanamine
CID 117396628
2-[1-(3,5-difluorophenyl)cyclopentyl]ethanamine
CID 83823340
1-fluoro-3-(1-isocyanatocyclopentyl)-5-propan-2-ylbenzene
CID 117370879
1-(3-fluoro-5-propan-2-ylphenyl)cyclopropane-1-carbonitrile
CID 84777395
[1-(3-fluoro-4,5-dimethylphenyl)cyclopentyl]methanamine
CID 84788177
1-(3-fluoro-5-propan-2-ylphenyl)cyclobutane-1-carboxylic acid
CID 84798152
[1-[3-(difluoromethyl)phenyl]cyclobutyl]methanamine
CID 117301607
[1-[3-(cyclobutylmethoxy)-5-fluorophenyl]cyclopentyl]methanamine
CID 117444778

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine?
The IUPAC name of [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine (CID 84797654) is [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine?
The canonical SMILES for [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine is CC(C)c1cc(F)cc(C2(CN)CCCC2)c1.
What is the InChIKey of [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine?
The InChIKey is YWKPHXWIQATNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN/c1-11(2)12-7-13(9-14(16)8-12)15(10-17)5-3-4-6-15/h7-9,11H,3-6,10,17H2,1-2H3.
What are the key properties of [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine?
[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine has a molecular weight of 235.35 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine is sourced from PubChem (CID 84797654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).