[6-(2-fluorophenyl)quinolin-2-yl]methanamine

C16H13FN2 — CID 150456453

IUPAC[6-(2-fluorophenyl)quinolin-2-yl]methanamine
SMILESNCc1ccc2cc(-c3ccccc3F)ccc2n1
InChIInChI=1S/C16H13FN2/c17-15-4-2-1-3-14(15)11-6-8-16-12(9-11)5-7-13(10-18)19-16/h1-9H,10,18H2
InChIKeyHOWRETRYQWFIGK-UHFFFAOYSA-N
MW252.29 g/mol
LogP3.50
Rot. Bonds2

About [6-(2-fluorophenyl)quinolin-2-yl]methanamine

[6-(2-fluorophenyl)quinolin-2-yl]methanamine (PubChem CID 150456453) has the molecular formula C16H13FN2 and a molecular weight of 252.29 g/mol. Its IUPAC name is [6-(2-fluorophenyl)quinolin-2-yl]methanamine.

Molecular Properties

Compound Name[6-(2-fluorophenyl)quinolin-2-yl]methanamine
PubChem CID150456453
Molecular FormulaC16H13FN2
Molecular Weight252.29 g/mol
Exact Mass252.11
IUPAC Name[6-(2-fluorophenyl)quinolin-2-yl]methanamine
SMILESNCc1ccc2cc(-c3ccccc3F)ccc2n1
InChIInChI=1S/C16H13FN2/c17-15-4-2-1-3-14(15)11-6-8-16-12(9-11)5-7-13(10-18)19-16/h1-9H,10,18H2
InChIKeyHOWRETRYQWFIGK-UHFFFAOYSA-N
XLogP3.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [6-(2-fluorophenyl)quinolin-2-yl]methanamine?
The IUPAC name of [6-(2-fluorophenyl)quinolin-2-yl]methanamine (CID 150456453) is [6-(2-fluorophenyl)quinolin-2-yl]methanamine.
What is the SMILES notation for [6-(2-fluorophenyl)quinolin-2-yl]methanamine?
The canonical SMILES for [6-(2-fluorophenyl)quinolin-2-yl]methanamine is NCc1ccc2cc(-c3ccccc3F)ccc2n1.
What is the InChIKey of [6-(2-fluorophenyl)quinolin-2-yl]methanamine?
The InChIKey is HOWRETRYQWFIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2/c17-15-4-2-1-3-14(15)11-6-8-16-12(9-11)5-7-13(10-18)19-16/h1-9H,10,18H2.
What are the key properties of [6-(2-fluorophenyl)quinolin-2-yl]methanamine?
[6-(2-fluorophenyl)quinolin-2-yl]methanamine has a molecular weight of 252.29 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-fluorophenyl)quinolin-2-yl]methanamine is sourced from PubChem (CID 150456453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).