[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine

C13H13FN2O — CID 64854594

IUPAC[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine
SMILESCc1ccc(F)c(Oc2ncccc2CN)c1
InChIInChI=1S/C13H13FN2O/c1-9-4-5-11(14)12(7-9)17-13-10(8-15)3-2-6-16-13/h2-7H,8,15H2,1H3
InChIKeyYMYPFLNUSGAEIE-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.78
Rot. Bonds3

About [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine

[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine (PubChem CID 64854594) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine
PubChem CID64854594
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC Name[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine
SMILESCc1ccc(F)c(Oc2ncccc2CN)c1
InChIInChI=1S/C13H13FN2O/c1-9-4-5-11(14)12(7-9)17-13-10(8-15)3-2-6-16-13/h2-7H,8,15H2,1H3
InChIKeyYMYPFLNUSGAEIE-UHFFFAOYSA-N
XLogP2.78
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluoro-5-methylphenoxy)pyridin-3-amine
CID 64855365
[2-(2-bromo-4-methylphenoxy)-3-pyridinyl]methanamine
CID 43528676
[2-(2-fluoro-5-methylphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 64853407
N-[[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 64854495
[5-bromo-2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine
CID 64854885
2-[2-(2,5-difluorophenoxy)-3-pyridinyl]ethanamine
CID 114057573
3-(2-fluoro-5-methylphenoxy)pyrazin-2-amine
CID 102988278
[2-(2-fluoro-5-methylphenoxy)quinolin-3-yl]methanamine
CID 64854395
[2-fluoro-3-[(2-fluoro-5-methylphenoxy)methyl]phenyl]methanamine
CID 107114161
[2-(2-bromo-4-chlorophenoxy)-3-pyridinyl]methanamine
CID 43528666
[2-(2,4-dibromophenoxy)-3-pyridinyl]methanamine
CID 64719510
[2-(2-chloro-4-methylphenoxy)-3-fluoro-4-pyridinyl]methanamine
CID 105391433

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine (CID 64854594) is [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine is Cc1ccc(F)c(Oc2ncccc2CN)c1.
What is the InChIKey of [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine?
The InChIKey is YMYPFLNUSGAEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c1-9-4-5-11(14)12(7-9)17-13-10(8-15)3-2-6-16-13/h2-7H,8,15H2,1H3.
What are the key properties of [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine?
[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine has a molecular weight of 232.26 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 64854594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).