4-benzyl-5-(methoxymethyl)pyridazine

C13H14N2O — CID 13205685

IUPAC4-benzyl-5-(methoxymethyl)pyridazine
SMILESCOCc1cnncc1Cc1ccccc1
InChIInChI=1S/C13H14N2O/c1-16-10-13-9-15-14-8-12(13)7-11-5-3-2-4-6-11/h2-6,8-9H,7,10H2,1H3
InChIKeyLASUXJPDFKAYLO-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.21
Rot. Bonds4

About 4-benzyl-5-(methoxymethyl)pyridazine

4-benzyl-5-(methoxymethyl)pyridazine (PubChem CID 13205685) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-benzyl-5-(methoxymethyl)pyridazine.

Molecular Properties

Compound Name4-benzyl-5-(methoxymethyl)pyridazine
PubChem CID13205685
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name4-benzyl-5-(methoxymethyl)pyridazine
SMILESCOCc1cnncc1Cc1ccccc1
InChIInChI=1S/C13H14N2O/c1-16-10-13-9-15-14-8-12(13)7-11-5-3-2-4-6-11/h2-6,8-9H,7,10H2,1H3
InChIKeyLASUXJPDFKAYLO-UHFFFAOYSA-N
XLogP2.21
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-benzyl-5-(methoxymethyl)pyridazine 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 4-benzyl-5-(methoxymethyl)pyridazine?
The IUPAC name of 4-benzyl-5-(methoxymethyl)pyridazine (CID 13205685) is 4-benzyl-5-(methoxymethyl)pyridazine.
What is the SMILES notation for 4-benzyl-5-(methoxymethyl)pyridazine?
The canonical SMILES for 4-benzyl-5-(methoxymethyl)pyridazine is COCc1cnncc1Cc1ccccc1.
What is the InChIKey of 4-benzyl-5-(methoxymethyl)pyridazine?
The InChIKey is LASUXJPDFKAYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-16-10-13-9-15-14-8-12(13)7-11-5-3-2-4-6-11/h2-6,8-9H,7,10H2,1H3.
What are the key properties of 4-benzyl-5-(methoxymethyl)pyridazine?
4-benzyl-5-(methoxymethyl)pyridazine has a molecular weight of 214.27 g/mol, XLogP of 2.21, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-5-(methoxymethyl)pyridazine is sourced from PubChem (CID 13205685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).