4-methyl-6-(3-methylphenoxy)pyridin-3-amine

C13H14N2O — CID 79020882

IUPAC4-methyl-6-(3-methylphenoxy)pyridin-3-amine
SMILESCc1cccc(Oc2cc(C)c(N)cn2)c1
InChIInChI=1S/C13H14N2O/c1-9-4-3-5-11(6-9)16-13-7-10(2)12(14)8-15-13/h3-8H,14H2,1-2H3
InChIKeyAHIXTGSWRBJULO-UHFFFAOYSA-N
MW214.27 g/mol
LogP3.07
Rot. Bonds2

About 4-methyl-6-(3-methylphenoxy)pyridin-3-amine

4-methyl-6-(3-methylphenoxy)pyridin-3-amine (PubChem CID 79020882) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-methyl-6-(3-methylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name4-methyl-6-(3-methylphenoxy)pyridin-3-amine
PubChem CID79020882
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name4-methyl-6-(3-methylphenoxy)pyridin-3-amine
SMILESCc1cccc(Oc2cc(C)c(N)cn2)c1
InChIInChI=1S/C13H14N2O/c1-9-4-3-5-11(6-9)16-13-7-10(2)12(14)8-15-13/h3-8H,14H2,1-2H3
InChIKeyAHIXTGSWRBJULO-UHFFFAOYSA-N
XLogP3.07
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(3-methylphenoxy)pyridin-3-amine?
The IUPAC name of 4-methyl-6-(3-methylphenoxy)pyridin-3-amine (CID 79020882) is 4-methyl-6-(3-methylphenoxy)pyridin-3-amine.
What is the SMILES notation for 4-methyl-6-(3-methylphenoxy)pyridin-3-amine?
The canonical SMILES for 4-methyl-6-(3-methylphenoxy)pyridin-3-amine is Cc1cccc(Oc2cc(C)c(N)cn2)c1.
What is the InChIKey of 4-methyl-6-(3-methylphenoxy)pyridin-3-amine?
The InChIKey is AHIXTGSWRBJULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9-4-3-5-11(6-9)16-13-7-10(2)12(14)8-15-13/h3-8H,14H2,1-2H3.
What are the key properties of 4-methyl-6-(3-methylphenoxy)pyridin-3-amine?
4-methyl-6-(3-methylphenoxy)pyridin-3-amine has a molecular weight of 214.27 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(3-methylphenoxy)pyridin-3-amine is sourced from PubChem (CID 79020882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).