4-methoxypyridazin-3-amine

C5H7N3O — CID 11147715

IUPAC4-methoxypyridazin-3-amine
SMILESCOc1ccnnc1N
InChIInChI=1S/C5H7N3O/c1-9-4-2-3-7-8-5(4)6/h2-3H,1H3,(H2,6,8)
InChIKeyZHMFSQJMTITBJA-UHFFFAOYSA-N
MW125.13 g/mol
LogP0.07
Rot. Bonds1

About 4-methoxypyridazin-3-amine

4-methoxypyridazin-3-amine (PubChem CID 11147715) has the molecular formula C5H7N3O and a molecular weight of 125.13 g/mol. Its IUPAC name is 4-methoxypyridazin-3-amine.

Molecular Properties

Compound Name4-methoxypyridazin-3-amine
PubChem CID11147715
Molecular FormulaC5H7N3O
Molecular Weight125.13 g/mol
Exact Mass125.06
IUPAC Name4-methoxypyridazin-3-amine
SMILESCOc1ccnnc1N
InChIInChI=1S/C5H7N3O/c1-9-4-2-3-7-8-5(4)6/h2-3H,1H3,(H2,6,8)
InChIKeyZHMFSQJMTITBJA-UHFFFAOYSA-N
XLogP0.07
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.13
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxypyridazin-3-amine?
The IUPAC name of 4-methoxypyridazin-3-amine (CID 11147715) is 4-methoxypyridazin-3-amine.
What is the SMILES notation for 4-methoxypyridazin-3-amine?
The canonical SMILES for 4-methoxypyridazin-3-amine is COc1ccnnc1N.
What is the InChIKey of 4-methoxypyridazin-3-amine?
The InChIKey is ZHMFSQJMTITBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O/c1-9-4-2-3-7-8-5(4)6/h2-3H,1H3,(H2,6,8).
What are the key properties of 4-methoxypyridazin-3-amine?
4-methoxypyridazin-3-amine has a molecular weight of 125.13 g/mol, XLogP of 0.07, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxypyridazin-3-amine is sourced from PubChem (CID 11147715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).