3-methyl-4,5-dihydropyridazine

C5H8N2 — CID 56634566

IUPAC3-methyl-4,5-dihydropyridazine
SMILESCC1=NN=CCC1
InChIInChI=1S/C5H8N2/c1-5-3-2-4-6-7-5/h4H,2-3H2,1H3
InChIKeyDUHYHGRCCWOAQB-UHFFFAOYSA-N
MW96.13 g/mol
LogP1.23
Rot. Bonds

About 3-methyl-4,5-dihydropyridazine

3-methyl-4,5-dihydropyridazine (PubChem CID 56634566) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is 3-methyl-4,5-dihydropyridazine.

Molecular Properties

Compound Name3-methyl-4,5-dihydropyridazine
PubChem CID56634566
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name3-methyl-4,5-dihydropyridazine
SMILESCC1=NN=CCC1
InChIInChI=1S/C5H8N2/c1-5-3-2-4-6-7-5/h4H,2-3H2,1H3
InChIKeyDUHYHGRCCWOAQB-UHFFFAOYSA-N
XLogP1.23
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methyl-4,5-dihydropyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4,5-dihydropyridazine?
The IUPAC name of 3-methyl-4,5-dihydropyridazine (CID 56634566) is 3-methyl-4,5-dihydropyridazine.
What is the SMILES notation for 3-methyl-4,5-dihydropyridazine?
The canonical SMILES for 3-methyl-4,5-dihydropyridazine is CC1=NN=CCC1.
What is the InChIKey of 3-methyl-4,5-dihydropyridazine?
The InChIKey is DUHYHGRCCWOAQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c1-5-3-2-4-6-7-5/h4H,2-3H2,1H3.
What are the key properties of 3-methyl-4,5-dihydropyridazine?
3-methyl-4,5-dihydropyridazine has a molecular weight of 96.13 g/mol, XLogP of 1.23, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4,5-dihydropyridazine is sourced from PubChem (CID 56634566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).