6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine

C14H16N2O — CID 80863130

IUPAC6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine
SMILESCNc1cccc(Oc2ccc(C)cc2C)n1
InChIInChI=1S/C14H16N2O/c1-10-7-8-12(11(2)9-10)17-14-6-4-5-13(15-3)16-14/h4-9H,1-3H3,(H,15,16)
InChIKeyHTEZZHBVKRLRBR-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.53
Rot. Bonds3

About 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine

6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine (PubChem CID 80863130) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine
PubChem CID80863130
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine
SMILESCNc1cccc(Oc2ccc(C)cc2C)n1
InChIInChI=1S/C14H16N2O/c1-10-7-8-12(11(2)9-10)17-14-6-4-5-13(15-3)16-14/h4-9H,1-3H3,(H,15,16)
InChIKeyHTEZZHBVKRLRBR-UHFFFAOYSA-N
XLogP3.53
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine?
The IUPAC name of 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine (CID 80863130) is 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine.
What is the SMILES notation for 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine?
The canonical SMILES for 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine is CNc1cccc(Oc2ccc(C)cc2C)n1.
What is the InChIKey of 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine?
The InChIKey is HTEZZHBVKRLRBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-10-7-8-12(11(2)9-10)17-14-6-4-5-13(15-3)16-14/h4-9H,1-3H3,(H,15,16).
What are the key properties of 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine?
6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine has a molecular weight of 228.29 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethylphenoxy)-N-methylpyridin-2-amine is sourced from PubChem (CID 80863130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).