[3-(2,4-difluorophenyl)phenyl]methanamine

C13H11F2N — CID 19079436

IUPAC[3-(2,4-difluorophenyl)phenyl]methanamine
SMILESNCc1cccc(-c2ccc(F)cc2F)c1
InChIInChI=1S/C13H11F2N/c14-11-4-5-12(13(15)7-11)10-3-1-2-9(6-10)8-16/h1-7H,8,16H2
InChIKeyXPRONEVMJTWASY-UHFFFAOYSA-N
MW219.23 g/mol
LogP3.09
Rot. Bonds2

About [3-(2,4-difluorophenyl)phenyl]methanamine

[3-(2,4-difluorophenyl)phenyl]methanamine (PubChem CID 19079436) has the molecular formula C13H11F2N and a molecular weight of 219.23 g/mol. Its IUPAC name is [3-(2,4-difluorophenyl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(2,4-difluorophenyl)phenyl]methanamine
PubChem CID19079436
Molecular FormulaC13H11F2N
Molecular Weight219.23 g/mol
Exact Mass219.09
IUPAC Name[3-(2,4-difluorophenyl)phenyl]methanamine
SMILESNCc1cccc(-c2ccc(F)cc2F)c1
InChIInChI=1S/C13H11F2N/c14-11-4-5-12(13(15)7-11)10-3-1-2-9(6-10)8-16/h1-7H,8,16H2
InChIKeyXPRONEVMJTWASY-UHFFFAOYSA-N
XLogP3.09
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.23
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [3-(2,4-difluorophenyl)phenyl]methanamine?
The IUPAC name of [3-(2,4-difluorophenyl)phenyl]methanamine (CID 19079436) is [3-(2,4-difluorophenyl)phenyl]methanamine.
What is the SMILES notation for [3-(2,4-difluorophenyl)phenyl]methanamine?
The canonical SMILES for [3-(2,4-difluorophenyl)phenyl]methanamine is NCc1cccc(-c2ccc(F)cc2F)c1.
What is the InChIKey of [3-(2,4-difluorophenyl)phenyl]methanamine?
The InChIKey is XPRONEVMJTWASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2N/c14-11-4-5-12(13(15)7-11)10-3-1-2-9(6-10)8-16/h1-7H,8,16H2.
What are the key properties of [3-(2,4-difluorophenyl)phenyl]methanamine?
[3-(2,4-difluorophenyl)phenyl]methanamine has a molecular weight of 219.23 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,4-difluorophenyl)phenyl]methanamine is sourced from PubChem (CID 19079436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).