6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine

C14H15ClN2O2 — CID 43262617

IUPAC6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine
SMILESCOc1nc(Oc2cc(C)c(Cl)c(C)c2)ccc1N
InChIInChI=1S/C14H15ClN2O2/c1-8-6-10(7-9(2)13(8)15)19-12-5-4-11(16)14(17-12)18-3/h4-7H,16H2,1-3H3
InChIKeyXKBRDBYJLUIHCZ-UHFFFAOYSA-N
MW278.74 g/mol
LogP3.73
Rot. Bonds3

About 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine

6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine (PubChem CID 43262617) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine.

Molecular Properties

Compound Name6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine
PubChem CID43262617
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine
SMILESCOc1nc(Oc2cc(C)c(Cl)c(C)c2)ccc1N
InChIInChI=1S/C14H15ClN2O2/c1-8-6-10(7-9(2)13(8)15)19-12-5-4-11(16)14(17-12)18-3/h4-7H,16H2,1-3H3
InChIKeyXKBRDBYJLUIHCZ-UHFFFAOYSA-N
XLogP3.73
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine?
The IUPAC name of 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine (CID 43262617) is 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine.
What is the SMILES notation for 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine?
The canonical SMILES for 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine is COc1nc(Oc2cc(C)c(Cl)c(C)c2)ccc1N.
What is the InChIKey of 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine?
The InChIKey is XKBRDBYJLUIHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c1-8-6-10(7-9(2)13(8)15)19-12-5-4-11(16)14(17-12)18-3/h4-7H,16H2,1-3H3.
What are the key properties of 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine?
6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine has a molecular weight of 278.74 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chloro-3,5-dimethylphenoxy)-2-methoxypyridin-3-amine is sourced from PubChem (CID 43262617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).