2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine

C15H22FN — CID 65299332

IUPAC2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine
SMILESCc1cc(C(N)CC2CCCC2)cc(C)c1F
InChIInChI=1S/C15H22FN/c1-10-7-13(8-11(2)15(10)16)14(17)9-12-5-3-4-6-12/h7-8,12,14H,3-6,9,17H2,1-2H3
InChIKeyRBRBJJSKNUICCM-UHFFFAOYSA-N
MW235.35 g/mol
LogP4.02
Rot. Bonds3

About 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine

2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine (PubChem CID 65299332) has the molecular formula C15H22FN and a molecular weight of 235.35 g/mol. Its IUPAC name is 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine
PubChem CID65299332
Molecular FormulaC15H22FN
Molecular Weight235.35 g/mol
Exact Mass235.17
IUPAC Name2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine
SMILESCc1cc(C(N)CC2CCCC2)cc(C)c1F
InChIInChI=1S/C15H22FN/c1-10-7-13(8-11(2)15(10)16)14(17)9-12-5-3-4-6-12/h7-8,12,14H,3-6,9,17H2,1-2H3
InChIKeyRBRBJJSKNUICCM-UHFFFAOYSA-N
XLogP4.02
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 ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclobutyl-1-(3,5-difluorophenyl)ethanamine
CID 65458373
2-cyclobutyl-1-(3-fluoro-4-methylphenyl)ethanamine
CID 65459488
2-(3-ethoxycyclobutyl)-1-(4-fluoro-3,5-dimethylphenyl)ethanamine
CID 103163178
cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine
CID 65299040
2-cyclohexyl-1-(2,3-difluoro-4-methylphenyl)ethanamine
CID 107515963
2-cyclopentyl-1-(3,5-dichlorophenyl)ethanamine
CID 115847384
N-[2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethyl]propan-1-amine
CID 65296826
2-cyclopropyl-1-(3,5-difluorophenyl)ethanamine
CID 55272126
2-cycloheptyl-1-(2-fluoro-4,6-dimethylphenyl)ethanamine
CID 106883593
5-[chloro(cyclopentyl)methyl]-2-fluoro-1,3-dimethylbenzene
CID 65297249
1-(4-bromo-2-methylphenyl)-2-cyclopentylethanamine
CID 115847235
2-cyclohexyl-1-(2,4,6-trifluorophenyl)ethanamine
CID 43104806

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine?
The IUPAC name of 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine (CID 65299332) is 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine?
The canonical SMILES for 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine is Cc1cc(C(N)CC2CCCC2)cc(C)c1F.
What is the InChIKey of 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine?
The InChIKey is RBRBJJSKNUICCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN/c1-10-7-13(8-11(2)15(10)16)14(17)9-12-5-3-4-6-12/h7-8,12,14H,3-6,9,17H2,1-2H3.
What are the key properties of 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine?
2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine has a molecular weight of 235.35 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine is sourced from PubChem (CID 65299332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).