2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine

C14H12F3N — CID 112566313

IUPAC2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine
SMILESNCC(F)(c1ccccc1)c1cc(F)ccc1F
InChIInChI=1S/C14H12F3N/c15-11-6-7-13(16)12(8-11)14(17,9-18)10-4-2-1-3-5-10/h1-8H,9,18H2
InChIKeyXKSYUVZWKZVNTM-UHFFFAOYSA-N
MW251.25 g/mol
LogP3.14
Rot. Bonds3

About 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine

2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine (PubChem CID 112566313) has the molecular formula C14H12F3N and a molecular weight of 251.25 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine
PubChem CID112566313
Molecular FormulaC14H12F3N
Molecular Weight251.25 g/mol
Exact Mass251.09
IUPAC Name2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine
SMILESNCC(F)(c1ccccc1)c1cc(F)ccc1F
InChIInChI=1S/C14H12F3N/c15-11-6-7-13(16)12(8-11)14(17,9-18)10-4-2-1-3-5-10/h1-8H,9,18H2
InChIKeyXKSYUVZWKZVNTM-UHFFFAOYSA-N
XLogP3.14
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.25
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-2-phenyl-2-(2,3,4-trifluorophenyl)ethanamine
CID 112566344
2-(2,5-difluorophenyl)-2-fluoropentan-1-amine
CID 112567838
2-(2,5-difluorophenyl)-2-fluoro-3-methylbutan-1-amine
CID 112566903
2-(3-bromo-2,6-difluorophenyl)-2-fluoro-2-phenylethanamine
CID 106943960
2-(4-tert-butylphenyl)-2-fluoro-2-phenylethanamine
CID 115918107
1-amino-2-(2,5-difluorophenyl)propan-2-ol
CID 62773185
2-(2,3-dimethylphenyl)-2-fluoro-2-phenylethanamine
CID 112566318
1-(2,5-difluorophenyl)-1-(3-fluorophenyl)propan-1-amine
CID 114872751
1-(3-chlorophenyl)-1-(2,5-difluorophenyl)ethanamine
CID 55120933
1-amino-3-(2,5-difluorophenoxy)-2-phenylpropan-2-ol
CID 64821682
1-(3-chlorophenyl)-1-(2,5-difluorophenyl)ethanol
CID 62802085
2-[2-(2,5-difluorophenyl)propan-2-yl]-1,4-difluorobenzene
CID 90465421

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine?
The IUPAC name of 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine (CID 112566313) is 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine.
What is the SMILES notation for 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine?
The canonical SMILES for 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine is NCC(F)(c1ccccc1)c1cc(F)ccc1F.
What is the InChIKey of 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine?
The InChIKey is XKSYUVZWKZVNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3N/c15-11-6-7-13(16)12(8-11)14(17,9-18)10-4-2-1-3-5-10/h1-8H,9,18H2.
What are the key properties of 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine?
2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine has a molecular weight of 251.25 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-2-fluoro-2-phenylethanamine is sourced from PubChem (CID 112566313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).