[1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine

C13H18FN — CID 84779814

IUPAC[1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine
SMILESCc1cc(F)cc(C2(CN)CCCC2)c1
InChIInChI=1S/C13H18FN/c1-10-6-11(8-12(14)7-10)13(9-15)4-2-3-5-13/h6-8H,2-5,9,15H2,1H3
InChIKeyKDJTZHJCRMCQTB-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.90
Rot. Bonds2

About [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine

[1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine (PubChem CID 84779814) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine
PubChem CID84779814
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name[1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine
SMILESCc1cc(F)cc(C2(CN)CCCC2)c1
InChIInChI=1S/C13H18FN/c1-10-6-11(8-12(14)7-10)13(9-15)4-2-3-5-13/h6-8H,2-5,9,15H2,1H3
InChIKeyKDJTZHJCRMCQTB-UHFFFAOYSA-N
XLogP2.90
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine
CID 84797654
[1-(3-chloro-5-methylphenyl)cyclohexyl]methanamine
CID 84799016
[1-(3,5-difluoro-4-methylphenyl)cyclohexyl]methanamine
CID 117351218
[1-(3-fluoro-4,5-dimethylphenyl)cyclopentyl]methanamine
CID 84788177
[1-(3-fluoro-5-methylsulfonylphenyl)cyclobutyl]methanamine
CID 117396628
2-[1-(3,5-difluorophenyl)cyclopentyl]ethanamine
CID 83823340
[1-[3-fluoro-4-(fluoromethyl)-5-methylphenyl]cyclopentyl]methanamine
CID 117351226
[4-(3,5-dimethylphenyl)oxan-4-yl]methanamine
CID 18525387
[1-(3-fluoro-4-methoxy-5-methylphenyl)cyclopentyl]methanamine
CID 117347260
[1-[3-(cyclobutylmethoxy)-5-fluorophenyl]cyclopentyl]methanamine
CID 117444778
[1-[3-fluoro-5-(trifluoromethyl)phenyl]cyclopropyl]methanamine
CID 75509980
1-(3-fluoro-5-methylphenyl)-2,2-dimethylcyclohexan-1-amine
CID 79836961

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine?
The IUPAC name of [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine (CID 84779814) is [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine?
The canonical SMILES for [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine is Cc1cc(F)cc(C2(CN)CCCC2)c1.
What is the InChIKey of [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine?
The InChIKey is KDJTZHJCRMCQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-10-6-11(8-12(14)7-10)13(9-15)4-2-3-5-13/h6-8H,2-5,9,15H2,1H3.
What are the key properties of [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine?
[1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine has a molecular weight of 207.29 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-5-methylphenyl)cyclopentyl]methanamine is sourced from PubChem (CID 84779814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).