1-[2-(2,4-difluorophenyl)phenyl]ethanamine

C14H13F2N — CID 22482376

IUPAC1-[2-(2,4-difluorophenyl)phenyl]ethanamine
SMILESCC(N)c1ccccc1-c1ccc(F)cc1F
InChIInChI=1S/C14H13F2N/c1-9(17)11-4-2-3-5-12(11)13-7-6-10(15)8-14(13)16/h2-9H,17H2,1H3
InChIKeyAEBRNFBTJDRRBX-UHFFFAOYSA-N
MW233.26 g/mol
LogP3.65
Rot. Bonds2

About 1-[2-(2,4-difluorophenyl)phenyl]ethanamine

1-[2-(2,4-difluorophenyl)phenyl]ethanamine (PubChem CID 22482376) has the molecular formula C14H13F2N and a molecular weight of 233.26 g/mol. Its IUPAC name is 1-[2-(2,4-difluorophenyl)phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(2,4-difluorophenyl)phenyl]ethanamine
PubChem CID22482376
Molecular FormulaC14H13F2N
Molecular Weight233.26 g/mol
Exact Mass233.10
IUPAC Name1-[2-(2,4-difluorophenyl)phenyl]ethanamine
SMILESCC(N)c1ccccc1-c1ccc(F)cc1F
InChIInChI=1S/C14H13F2N/c1-9(17)11-4-2-3-5-12(11)13-7-6-10(15)8-14(13)16/h2-9H,17H2,1H3
InChIKeyAEBRNFBTJDRRBX-UHFFFAOYSA-N
XLogP3.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,4-difluorophenyl)phenyl]ethanamine?
The IUPAC name of 1-[2-(2,4-difluorophenyl)phenyl]ethanamine (CID 22482376) is 1-[2-(2,4-difluorophenyl)phenyl]ethanamine.
What is the SMILES notation for 1-[2-(2,4-difluorophenyl)phenyl]ethanamine?
The canonical SMILES for 1-[2-(2,4-difluorophenyl)phenyl]ethanamine is CC(N)c1ccccc1-c1ccc(F)cc1F.
What is the InChIKey of 1-[2-(2,4-difluorophenyl)phenyl]ethanamine?
The InChIKey is AEBRNFBTJDRRBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N/c1-9(17)11-4-2-3-5-12(11)13-7-6-10(15)8-14(13)16/h2-9H,17H2,1H3.
What are the key properties of 1-[2-(2,4-difluorophenyl)phenyl]ethanamine?
1-[2-(2,4-difluorophenyl)phenyl]ethanamine has a molecular weight of 233.26 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,4-difluorophenyl)phenyl]ethanamine is sourced from PubChem (CID 22482376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).