[3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine

C15H19N3O2 — CID 61096426

IUPAC[3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine
SMILESCOc1ccc(COc2nnc(C)c(C)c2CN)cc1
InChIInChI=1S/C15H19N3O2/c1-10-11(2)17-18-15(14(10)8-16)20-9-12-4-6-13(19-3)7-5-12/h4-7H,8-9,16H2,1-3H3
InChIKeyNRINJIZWTDJHJP-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.14
Rot. Bonds5

About [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine

[3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine (PubChem CID 61096426) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine
PubChem CID61096426
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name[3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine
SMILESCOc1ccc(COc2nnc(C)c(C)c2CN)cc1
InChIInChI=1S/C15H19N3O2/c1-10-11(2)17-18-15(14(10)8-16)20-9-12-4-6-13(19-3)7-5-12/h4-7H,8-9,16H2,1-3H3
InChIKeyNRINJIZWTDJHJP-UHFFFAOYSA-N
XLogP2.14
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-N-[(4-methoxyphenyl)methyl]-N,5,6-trimethylpyridazin-3-amine
CID 61419921
[5,6-dimethyl-3-(2-phenoxyethoxy)pyridazin-4-yl]methanamine
CID 61098225
[3-(4-ethyl-2-methoxyphenoxy)-5,6-dimethylpyridazin-4-yl]methanamine
CID 107663637
[5-[(4-methoxyphenyl)methoxy]-1,3-dimethylpyrazol-4-yl]methanamine
CID 28966353
(5,6-dimethyl-3-naphthalen-2-yloxypyridazin-4-yl)methanamine
CID 61097627
(3-hexoxy-5,6-dimethylpyridazin-4-yl)methanamine
CID 61097427
[3-(4-tert-butylphenoxy)-5,6-dimethylpyridazin-4-yl]methanamine
CID 61096822
[3-(4-butan-2-ylphenoxy)-5,6-dimethylpyridazin-4-yl]methanamine
CID 107663591
2-[(4-methoxyphenyl)methoxy]-6-methylpyridin-3-amine
CID 81133075
[4-[(4-methoxyphenyl)methoxy]-3-methylphenyl]methanamine
CID 54934427
[3-(2-ethoxyphenoxy)-5,6-dimethylpyridazin-4-yl]methanamine
CID 61096422
[3-(2-butoxyethoxy)-5,6-dimethylpyridazin-4-yl]methanamine
CID 61097023

Frequently Asked Questions

What is the IUPAC name of [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine?
The IUPAC name of [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine (CID 61096426) is [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine.
What is the SMILES notation for [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine?
The canonical SMILES for [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine is COc1ccc(COc2nnc(C)c(C)c2CN)cc1.
What is the InChIKey of [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine?
The InChIKey is NRINJIZWTDJHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-10-11(2)17-18-15(14(10)8-16)20-9-12-4-6-13(19-3)7-5-12/h4-7H,8-9,16H2,1-3H3.
What are the key properties of [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine?
[3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine has a molecular weight of 273.34 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(4-methoxyphenyl)methoxy]-5,6-dimethylpyridazin-4-yl]methanamine is sourced from PubChem (CID 61096426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).