3-ethoxy-5-methylpyridazine

C7H10N2O — CID 141355642

IUPAC3-ethoxy-5-methylpyridazine
SMILESCCOc1cc(C)cnn1
InChIInChI=1S/C7H10N2O/c1-3-10-7-4-6(2)5-8-9-7/h4-5H,3H2,1-2H3
InChIKeyZALUHCAJMPBCBC-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.18
Rot. Bonds2

About 3-ethoxy-5-methylpyridazine

3-ethoxy-5-methylpyridazine (PubChem CID 141355642) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-ethoxy-5-methylpyridazine.

Molecular Properties

Compound Name3-ethoxy-5-methylpyridazine
PubChem CID141355642
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-ethoxy-5-methylpyridazine
SMILESCCOc1cc(C)cnn1
InChIInChI=1S/C7H10N2O/c1-3-10-7-4-6(2)5-8-9-7/h4-5H,3H2,1-2H3
InChIKeyZALUHCAJMPBCBC-UHFFFAOYSA-N
XLogP1.18
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-5-methylpyridazine?
The IUPAC name of 3-ethoxy-5-methylpyridazine (CID 141355642) is 3-ethoxy-5-methylpyridazine.
What is the SMILES notation for 3-ethoxy-5-methylpyridazine?
The canonical SMILES for 3-ethoxy-5-methylpyridazine is CCOc1cc(C)cnn1.
What is the InChIKey of 3-ethoxy-5-methylpyridazine?
The InChIKey is ZALUHCAJMPBCBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-3-10-7-4-6(2)5-8-9-7/h4-5H,3H2,1-2H3.
What are the key properties of 3-ethoxy-5-methylpyridazine?
3-ethoxy-5-methylpyridazine has a molecular weight of 138.17 g/mol, XLogP of 1.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-5-methylpyridazine is sourced from PubChem (CID 141355642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).