3-[(3-methoxyphenyl)methyl]pyridazine

C12H12N2O — CID 117106572

IUPAC3-[(3-methoxyphenyl)methyl]pyridazine
SMILESCOc1cccc(Cc2cccnn2)c1
InChIInChI=1S/C12H12N2O/c1-15-12-6-2-4-10(9-12)8-11-5-3-7-13-14-11/h2-7,9H,8H2,1H3
InChIKeyNVUWIBWSYNRKKS-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.08
Rot. Bonds3

About 3-[(3-methoxyphenyl)methyl]pyridazine

3-[(3-methoxyphenyl)methyl]pyridazine (PubChem CID 117106572) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 3-[(3-methoxyphenyl)methyl]pyridazine.

Molecular Properties

Compound Name3-[(3-methoxyphenyl)methyl]pyridazine
PubChem CID117106572
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name3-[(3-methoxyphenyl)methyl]pyridazine
SMILESCOc1cccc(Cc2cccnn2)c1
InChIInChI=1S/C12H12N2O/c1-15-12-6-2-4-10(9-12)8-11-5-3-7-13-14-11/h2-7,9H,8H2,1H3
InChIKeyNVUWIBWSYNRKKS-UHFFFAOYSA-N
XLogP2.08
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-[(3-methoxyphenyl)methyl]pyridazine with MolForge

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

Launch Full Analysis

Related Compounds

2-bromo-6-[(3-methoxyphenyl)methyl]pyridine
CID 54045863
1-(3-methoxyphenyl)-N-(pyridazin-3-ylmethyl)ethanamine
CID 106895169
2,5-bis[(3-methoxyphenyl)methyl]pyridine
CID 91067305
4-bromo-6-[(3-methoxyphenyl)methyl]pyridazin-3-amine
CID 117106594
3-[(3-methoxyphenyl)methyl]-5-methyl-1H-pyrazole
CID 82076606
[3-[(3-methoxyphenyl)methoxy]pyridazin-4-yl]methanamine
CID 80508057
6-[(3-methoxyphenyl)methyl]quinoline
CID 172878073
3-[(3-methoxyphenyl)methyl]-1H-pyridazin-6-one
CID 11769880
6-[(3-methoxyphenyl)methyl]pyrimidine-4-carbonitrile
CID 121206299
1-ethyl-3-methoxybenzene;hydrofluoride
CID 174493623
(3-methoxyphenyl)(113C)methanol
CID 11593446
(3-methoxyphenyl)methanethiol
CID 10749403

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxyphenyl)methyl]pyridazine?
The IUPAC name of 3-[(3-methoxyphenyl)methyl]pyridazine (CID 117106572) is 3-[(3-methoxyphenyl)methyl]pyridazine.
What is the SMILES notation for 3-[(3-methoxyphenyl)methyl]pyridazine?
The canonical SMILES for 3-[(3-methoxyphenyl)methyl]pyridazine is COc1cccc(Cc2cccnn2)c1.
What is the InChIKey of 3-[(3-methoxyphenyl)methyl]pyridazine?
The InChIKey is NVUWIBWSYNRKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-15-12-6-2-4-10(9-12)8-11-5-3-7-13-14-11/h2-7,9H,8H2,1H3.
What are the key properties of 3-[(3-methoxyphenyl)methyl]pyridazine?
3-[(3-methoxyphenyl)methyl]pyridazine has a molecular weight of 200.24 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxyphenyl)methyl]pyridazine is sourced from PubChem (CID 117106572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).