[6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine

C13H14ClN3O — CID 82303524

IUPAC[6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine
SMILESCOc1c(C)cc(Cl)cc1-c1ccc(CN)nn1
InChIInChI=1S/C13H14ClN3O/c1-8-5-9(14)6-11(13(8)18-2)12-4-3-10(7-15)16-17-12/h3-6H,7,15H2,1-2H3
InChIKeyGQEJWWBBDHMEPJ-UHFFFAOYSA-N
MW263.73 g/mol
LogP2.57
Rot. Bonds3

About [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine

[6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine (PubChem CID 82303524) has the molecular formula C13H14ClN3O and a molecular weight of 263.73 g/mol. Its IUPAC name is [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine
PubChem CID82303524
Molecular FormulaC13H14ClN3O
Molecular Weight263.73 g/mol
Exact Mass263.08
IUPAC Name[6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine
SMILESCOc1c(C)cc(Cl)cc1-c1ccc(CN)nn1
InChIInChI=1S/C13H14ClN3O/c1-8-5-9(14)6-11(13(8)18-2)12-4-3-10(7-15)16-17-12/h3-6H,7,15H2,1-2H3
InChIKeyGQEJWWBBDHMEPJ-UHFFFAOYSA-N
XLogP2.57
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.73
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine 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-[3-(5-chloro-2-methoxy-3-methylphenyl)-1H-pyrazol-5-yl]ethanamine
CID 82486872
5-(5-chloro-2-methoxy-3-methylphenyl)-1H-pyrazole
CID 116869044
4-(5-chloro-2-methoxy-3-methylphenyl)-2-methyl-1,3-thiazole
CID 116967848
4-(5-chloro-2-methoxy-3-methylphenyl)-2-ethyltriazole
CID 167276473
5-(5-chloro-2-methoxy-3-methylphenyl)-4-iodo-1H-pyrazol-3-amine
CID 3570755
2-(bromomethyl)-4-(5-chloro-2-methoxy-3-methylphenyl)-1,3-thiazole
CID 116970319
[5-(5-chloro-2-methoxy-3-methylphenyl)-1H-imidazol-2-yl]methanethiol
CID 116879196
6-(5-chloro-2-methoxy-3-methylphenyl)-1,2,4-triazin-5-amine
CID 116823026
3-amino-1-(5-chloro-2-methoxy-3-methylphenyl)-2-hydroxypropan-1-one
CID 116826612
2-[6-(4-methoxy-2,3-dimethylphenyl)pyridazin-3-yl]ethanamine
CID 82300077
4-bromo-3-(5-chloro-2-methoxy-3-methylphenyl)-5-methyl-1H-pyrazole
CID 116856682
[6-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]methanamine
CID 62296897

Frequently Asked Questions

What is the IUPAC name of [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine?
The IUPAC name of [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine (CID 82303524) is [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine?
The canonical SMILES for [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine is COc1c(C)cc(Cl)cc1-c1ccc(CN)nn1.
What is the InChIKey of [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine?
The InChIKey is GQEJWWBBDHMEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O/c1-8-5-9(14)6-11(13(8)18-2)12-4-3-10(7-15)16-17-12/h3-6H,7,15H2,1-2H3.
What are the key properties of [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine?
[6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine has a molecular weight of 263.73 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(5-chloro-2-methoxy-3-methylphenyl)pyridazin-3-yl]methanamine is sourced from PubChem (CID 82303524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).