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

C14H14F2N2O — CID 55111900

IUPAC[2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
SMILESCc1cc(C)c(CN)c(Oc2cc(F)cc(F)c2)n1
InChIInChI=1S/C14H14F2N2O/c1-8-3-9(2)18-14(13(8)7-17)19-12-5-10(15)4-11(16)6-12/h3-6H,7,17H2,1-2H3
InChIKeyXCNBPOVJHSLKHL-UHFFFAOYSA-N
MW264.27 g/mol
LogP3.23
Rot. Bonds3

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

[2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine (PubChem CID 55111900) has the molecular formula C14H14F2N2O and a molecular weight of 264.27 g/mol. Its IUPAC name is [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
PubChem CID55111900
Molecular FormulaC14H14F2N2O
Molecular Weight264.27 g/mol
Exact Mass264.11
IUPAC Name[2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
SMILESCc1cc(C)c(CN)c(Oc2cc(F)cc(F)c2)n1
InChIInChI=1S/C14H14F2N2O/c1-8-3-9(2)18-14(13(8)7-17)19-12-5-10(15)4-11(16)6-12/h3-6H,7,17H2,1-2H3
InChIKeyXCNBPOVJHSLKHL-UHFFFAOYSA-N
XLogP3.23
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
CID 62783602
1-[2-(3-bromo-5-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
CID 81326308
[2-(4-ethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 61175556
[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 64853800
[2-(3-chlorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 61175170
[2-(4-bromo-2-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 61175759
[2-(5-bromo-2-fluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 114671610
2-(3,5-difluorophenoxy)-4,6-dimethylpyridine-3-carbothioamide
CID 62786363
[4,6-dimethyl-2-(4-methylsulfonylphenoxy)-3-pyridinyl]methanamine
CID 61175958
[2-(2-bromo-4-methoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 104706382
2-(3-bromo-5-fluorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 81331677
[2-[[3-(aminomethyl)-4,6-dimethyl-2-pyridinyl]oxy]phenyl]methanol
CID 63653421

Frequently Asked Questions

What is the IUPAC name of [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The IUPAC name of [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine (CID 55111900) is [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The canonical SMILES for [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine is Cc1cc(C)c(CN)c(Oc2cc(F)cc(F)c2)n1.
What is the InChIKey of [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
The InChIKey is XCNBPOVJHSLKHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-8-3-9(2)18-14(13(8)7-17)19-12-5-10(15)4-11(16)6-12/h3-6H,7,17H2,1-2H3.
What are the key properties of [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine?
[2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine has a molecular weight of 264.27 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,5-difluorophenoxy)-4,6-dimethyl-3-pyridinyl]methanamine is sourced from PubChem (CID 55111900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).