3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine

C11H12Cl2N4O — CID 102761085

IUPAC3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine
SMILESCNc1nc(Oc2cc(C)nn2C)c(Cl)cc1Cl
InChIInChI=1S/C11H12Cl2N4O/c1-6-4-9(17(3)16-6)18-11-8(13)5-7(12)10(14-2)15-11/h4-5H,1-3H3,(H,14,15)
InChIKeyJYNVMZRJBFQVJY-UHFFFAOYSA-N
MW287.15 g/mol
LogP3.26
Rot. Bonds3

About 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine

3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine (PubChem CID 102761085) has the molecular formula C11H12Cl2N4O and a molecular weight of 287.15 g/mol. Its IUPAC name is 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine
PubChem CID102761085
Molecular FormulaC11H12Cl2N4O
Molecular Weight287.15 g/mol
Exact Mass286.04
IUPAC Name3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine
SMILESCNc1nc(Oc2cc(C)nn2C)c(Cl)cc1Cl
InChIInChI=1S/C11H12Cl2N4O/c1-6-4-9(17(3)16-6)18-11-8(13)5-7(12)10(14-2)15-11/h4-5H,1-3H3,(H,14,15)
InChIKeyJYNVMZRJBFQVJY-UHFFFAOYSA-N
XLogP3.26
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.15
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine (CID 102761085) is 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine is CNc1nc(Oc2cc(C)nn2C)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine?
The InChIKey is JYNVMZRJBFQVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Cl2N4O/c1-6-4-9(17(3)16-6)18-11-8(13)5-7(12)10(14-2)15-11/h4-5H,1-3H3,(H,14,15).
What are the key properties of 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine?
3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine has a molecular weight of 287.15 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine is sourced from PubChem (CID 102761085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).