1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine

C14H14N6O — CID 151076060

IUPAC1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine
SMILESCNc1cc(-c2ccccn2)n(-c2ccc(OC)nn2)n1
InChIInChI=1S/C14H14N6O/c1-15-12-9-11(10-5-3-4-8-16-10)20(19-12)13-6-7-14(21-2)18-17-13/h3-9H,1-2H3,(H,15,19)
InChIKeyMJDFJCLRDUXKHV-UHFFFAOYSA-N
MW282.31 g/mol
LogP1.77
Rot. Bonds4

About 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine

1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine (PubChem CID 151076060) has the molecular formula C14H14N6O and a molecular weight of 282.31 g/mol. Its IUPAC name is 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine.

Molecular Properties

Compound Name1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine
PubChem CID151076060
Molecular FormulaC14H14N6O
Molecular Weight282.31 g/mol
Exact Mass282.12
IUPAC Name1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine
SMILESCNc1cc(-c2ccccn2)n(-c2ccc(OC)nn2)n1
InChIInChI=1S/C14H14N6O/c1-15-12-9-11(10-5-3-4-8-16-10)20(19-12)13-6-7-14(21-2)18-17-13/h3-9H,1-2H3,(H,15,19)
InChIKeyMJDFJCLRDUXKHV-UHFFFAOYSA-N
XLogP1.77
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine?
The IUPAC name of 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine (CID 151076060) is 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine.
What is the SMILES notation for 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine?
The canonical SMILES for 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine is CNc1cc(-c2ccccn2)n(-c2ccc(OC)nn2)n1.
What is the InChIKey of 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine?
The InChIKey is MJDFJCLRDUXKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6O/c1-15-12-9-11(10-5-3-4-8-16-10)20(19-12)13-6-7-14(21-2)18-17-13/h3-9H,1-2H3,(H,15,19).
What are the key properties of 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine?
1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine has a molecular weight of 282.31 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxypyridazin-3-yl)-N-methyl-5-pyridin-2-ylpyrazol-3-amine is sourced from PubChem (CID 151076060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).