1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine

C16H24FN — CID 64767965

IUPAC1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine
SMILESCC(C)(c1ccc(F)cc1)C(N)C1CCCCC1
InChIInChI=1S/C16H24FN/c1-16(2,13-8-10-14(17)11-9-13)15(18)12-6-4-3-5-7-12/h8-12,15H,3-7,18H2,1-2H3
InChIKeyXCRUSIQQJWTZCJ-UHFFFAOYSA-N
MW249.37 g/mol
LogP4.01
Rot. Bonds3

About 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine

1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine (PubChem CID 64767965) has the molecular formula C16H24FN and a molecular weight of 249.37 g/mol. Its IUPAC name is 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine
PubChem CID64767965
Molecular FormulaC16H24FN
Molecular Weight249.37 g/mol
Exact Mass249.19
IUPAC Name1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine
SMILESCC(C)(c1ccc(F)cc1)C(N)C1CCCCC1
InChIInChI=1S/C16H24FN/c1-16(2,13-8-10-14(17)11-9-13)15(18)12-6-4-3-5-7-12/h8-12,15H,3-7,18H2,1-2H3
InChIKeyXCRUSIQQJWTZCJ-UHFFFAOYSA-N
XLogP4.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-cycloheptyl-2-(4-fluorophenyl)-2-methylpropyl]hydrazine
CID 105223583
1-(3,5-dimethylcyclohexyl)-2-(4-fluorophenyl)-2-methylpropan-1-amine
CID 64769923
1-cyclopropyl-3-(4-fluorophenyl)-3-methylbutan-2-amine
CID 64904886
[1-cyclobutyl-3-(4-fluorophenyl)-3-methylbutan-2-yl]hydrazine
CID 105223629
1-cyclohexyl-2-(4-fluorophenyl)propan-2-amine
CID 62621993
1-cyclopentyl-2,2-difluoropropan-1-amine
CID 84651643
1-(4-ethylcyclohexyl)-2-methyl-2-phenylpropan-1-amine
CID 64775859
2-(4-tert-butylphenyl)-1-cyclohexylethanamine
CID 63411930
1-(4-tert-butylphenyl)-2-cycloheptylethanamine
CID 114457473
1-cycloheptyl-2-(4-fluorophenyl)-2-methylpropan-1-one
CID 82931291
1-cyclohexyl-2-ethyl-2-phenylbutan-1-amine
CID 63418081
1-(2,6-difluorophenyl)-2-(4-fluorophenyl)-2-methylpropan-1-amine
CID 64770314

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine?
The IUPAC name of 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine (CID 64767965) is 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine.
What is the SMILES notation for 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine?
The canonical SMILES for 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine is CC(C)(c1ccc(F)cc1)C(N)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine?
The InChIKey is XCRUSIQQJWTZCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN/c1-16(2,13-8-10-14(17)11-9-13)15(18)12-6-4-3-5-7-12/h8-12,15H,3-7,18H2,1-2H3.
What are the key properties of 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine?
1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine has a molecular weight of 249.37 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(4-fluorophenyl)-2-methylpropan-1-amine is sourced from PubChem (CID 64767965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).