2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride

C14H15ClFN — CID 164885898

IUPAC2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride
SMILESCl.NCCc1ccccc1-c1cccc(F)c1
InChIInChI=1S/C14H14FN.ClH/c15-13-6-3-5-12(10-13)14-7-2-1-4-11(14)8-9-16;/h1-7,10H,8-9,16H2;1H
InChIKeyONIQXAPVPPXFPH-UHFFFAOYSA-N
MW251.73 g/mol
LogP3.42
Rot. Bonds3

About 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride

2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride (PubChem CID 164885898) has the molecular formula C14H15ClFN and a molecular weight of 251.73 g/mol. Its IUPAC name is 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride.

Molecular Properties

Compound Name2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride
PubChem CID164885898
Molecular FormulaC14H15ClFN
Molecular Weight251.73 g/mol
Exact Mass251.09
IUPAC Name2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride
SMILESCl.NCCc1ccccc1-c1cccc(F)c1
InChIInChI=1S/C14H14FN.ClH/c15-13-6-3-5-12(10-13)14-7-2-1-4-11(14)8-9-16;/h1-7,10H,8-9,16H2;1H
InChIKeyONIQXAPVPPXFPH-UHFFFAOYSA-N
XLogP3.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.73
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride?
The IUPAC name of 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride (CID 164885898) is 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride.
What is the SMILES notation for 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride?
The canonical SMILES for 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride is Cl.NCCc1ccccc1-c1cccc(F)c1.
What is the InChIKey of 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride?
The InChIKey is ONIQXAPVPPXFPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN.ClH/c15-13-6-3-5-12(10-13)14-7-2-1-4-11(14)8-9-16;/h1-7,10H,8-9,16H2;1H.
What are the key properties of 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride?
2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride has a molecular weight of 251.73 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride is sourced from PubChem (CID 164885898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).