1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine

C14H17N3O3 — CID 62295663

IUPAC1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine
SMILESCNCc1ccc(Oc2c(OC)cccc2OC)nn1
InChIInChI=1S/C14H17N3O3/c1-15-9-10-7-8-13(17-16-10)20-14-11(18-2)5-4-6-12(14)19-3/h4-8,15H,9H2,1-3H3
InChIKeyCCJBUAGTHPMFBI-UHFFFAOYSA-N
MW275.31 g/mol
LogP2.01
Rot. Bonds6

About 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine

1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine (PubChem CID 62295663) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine
PubChem CID62295663
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine
SMILESCNCc1ccc(Oc2c(OC)cccc2OC)nn1
InChIInChI=1S/C14H17N3O3/c1-15-9-10-7-8-13(17-16-10)20-14-11(18-2)5-4-6-12(14)19-3/h4-8,15H,9H2,1-3H3
InChIKeyCCJBUAGTHPMFBI-UHFFFAOYSA-N
XLogP2.01
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[6-(3-methoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine
CID 62297460
1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62298293
N-methyl-1-[6-(2-propoxyphenoxy)pyridazin-3-yl]methanamine
CID 62296888
N-[[6-(2-methoxyphenoxy)pyridazin-3-yl]methyl]propan-1-amine
CID 62321643
N-methyl-1-[6-(4-propan-2-ylphenoxy)pyridazin-3-yl]methanamine
CID 62297796
1-[6-(2,4-dimethoxy-3-methylphenyl)pyridazin-3-yl]-N-methylmethanamine
CID 95475627
N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107381670
1-(6-butan-2-yloxypyridazin-3-yl)-N-methylmethanamine
CID 62296817
N-[[6-(2,3-dimethylphenoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 62296582
N-[[6-(2-fluoro-3-methylphenoxy)pyridazin-3-yl]methyl]propan-2-amine
CID 107660920
1-[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]-N-methylmethanamine
CID 63936765
3-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridazine
CID 61268428

Frequently Asked Questions

What is the IUPAC name of 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine (CID 62295663) is 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine is CNCc1ccc(Oc2c(OC)cccc2OC)nn1.
What is the InChIKey of 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine?
The InChIKey is CCJBUAGTHPMFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-15-9-10-7-8-13(17-16-10)20-14-11(18-2)5-4-6-12(14)19-3/h4-8,15H,9H2,1-3H3.
What are the key properties of 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine?
1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine has a molecular weight of 275.31 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2,6-dimethoxyphenoxy)pyridazin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 62295663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).