1-(4-fluorophenyl)ethenamine

C8H8FN — CID 70320635

IUPAC1-(4-fluorophenyl)ethenamine
SMILESC=C(N)c1ccc(F)cc1
InChIInChI=1S/C8H8FN/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1,10H2
InChIKeyRVSUGQITUFVEAY-UHFFFAOYSA-N
MW137.16 g/mol
LogP1.76
Rot. Bonds1

About 1-(4-fluorophenyl)ethenamine

1-(4-fluorophenyl)ethenamine (PubChem CID 70320635) has the molecular formula C8H8FN and a molecular weight of 137.16 g/mol. Its IUPAC name is 1-(4-fluorophenyl)ethenamine.

Molecular Properties

Compound Name1-(4-fluorophenyl)ethenamine
PubChem CID70320635
Molecular FormulaC8H8FN
Molecular Weight137.16 g/mol
Exact Mass137.06
IUPAC Name1-(4-fluorophenyl)ethenamine
SMILESC=C(N)c1ccc(F)cc1
InChIInChI=1S/C8H8FN/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1,10H2
InChIKeyRVSUGQITUFVEAY-UHFFFAOYSA-N
XLogP1.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.16
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)ethenamine?
The IUPAC name of 1-(4-fluorophenyl)ethenamine (CID 70320635) is 1-(4-fluorophenyl)ethenamine.
What is the SMILES notation for 1-(4-fluorophenyl)ethenamine?
The canonical SMILES for 1-(4-fluorophenyl)ethenamine is C=C(N)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)ethenamine?
The InChIKey is RVSUGQITUFVEAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1,10H2.
What are the key properties of 1-(4-fluorophenyl)ethenamine?
1-(4-fluorophenyl)ethenamine has a molecular weight of 137.16 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)ethenamine is sourced from PubChem (CID 70320635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).