[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine

C15H17FN2O — CID 64853800

IUPAC[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
SMILESCc1ccc(F)c(Oc2nc(C)cc(C)c2CN)c1
InChIInChI=1S/C15H17FN2O/c1-9-4-5-13(16)14(6-9)19-15-12(8-17)10(2)7-11(3)18-15/h4-7H,8,17H2,1-3H3
InChIKeyVMIUDAGPIHMAGN-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.40
Rot. Bonds3

About [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine

[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine (PubChem CID 64853800) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
PubChem CID64853800
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
SMILESCc1ccc(F)c(Oc2nc(C)cc(C)c2CN)c1
InChIInChI=1S/C15H17FN2O/c1-9-4-5-13(16)14(6-9)19-15-12(8-17)10(2)7-11(3)18-15/h4-7H,8,17H2,1-3H3
InChIKeyVMIUDAGPIHMAGN-UHFFFAOYSA-N
XLogP3.40
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(5-bromo-2-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 114671610
[4,6-dimethyl-2-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 61176130
[2-(4-bromo-2-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 61175759
[2-(2-fluoro-5-methylphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 64853407
[2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 55111900
[2-(3-chlorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 61175170
[2-[[3-(aminomethyl)-4,6-dimethyl-2-pyridinyl]oxy]phenyl]methanol
CID 63653421
[2-(4-ethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 61175556
[2-(2-bromo-4-methoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 104706382
[5-bromo-2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanamine
CID 64854885
[2-(2-fluoro-5-methylphenoxy)-6-methylpyrimidin-4-yl]methanol
CID 114219978
2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid
CID 64856053

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The IUPAC name of [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine (CID 64853800) is [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The canonical SMILES for [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine is Cc1ccc(F)c(Oc2nc(C)cc(C)c2CN)c1.
What is the InChIKey of [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The InChIKey is VMIUDAGPIHMAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-9-4-5-13(16)14(6-9)19-15-12(8-17)10(2)7-11(3)18-15/h4-7H,8,17H2,1-3H3.
What are the key properties of [2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine has a molecular weight of 260.31 g/mol, XLogP of 3.40, 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)-4,6-dimethyl-3-pyridinyl]methanamine is sourced from PubChem (CID 64853800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).