2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine

C15H19F2N — CID 23646094

IUPAC2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine
SMILESFC(CNCc1ccc(F)cc1)=C1CCCCC1
InChIInChI=1S/C15H19F2N/c16-14-8-6-12(7-9-14)10-18-11-15(17)13-4-2-1-3-5-13/h6-9,18H,1-5,10-11H2
InChIKeyWTEUADIZKYHXJG-UHFFFAOYSA-N
MW251.32 g/mol
LogP4.10
Rot. Bonds4

About 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine

2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine (PubChem CID 23646094) has the molecular formula C15H19F2N and a molecular weight of 251.32 g/mol. Its IUPAC name is 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine.

Molecular Properties

Compound Name2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine
PubChem CID23646094
Molecular FormulaC15H19F2N
Molecular Weight251.32 g/mol
Exact Mass251.15
IUPAC Name2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine
SMILESFC(CNCc1ccc(F)cc1)=C1CCCCC1
InChIInChI=1S/C15H19F2N/c16-14-8-6-12(7-9-14)10-18-11-15(17)13-4-2-1-3-5-13/h6-9,18H,1-5,10-11H2
InChIKeyWTEUADIZKYHXJG-UHFFFAOYSA-N
XLogP4.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.32
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine?
The IUPAC name of 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine (CID 23646094) is 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine.
What is the SMILES notation for 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine?
The canonical SMILES for 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine is FC(CNCc1ccc(F)cc1)=C1CCCCC1.
What is the InChIKey of 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine?
The InChIKey is WTEUADIZKYHXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2N/c16-14-8-6-12(7-9-14)10-18-11-15(17)13-4-2-1-3-5-13/h6-9,18H,1-5,10-11H2.
What are the key properties of 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine?
2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine has a molecular weight of 251.32 g/mol, XLogP of 4.10, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylidene-2-fluoro-N-[(4-fluorophenyl)methyl]ethanamine is sourced from PubChem (CID 23646094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).