6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine

C13H15N3O — CID 62203548

IUPAC6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine
SMILESCCOc1ccc(-c2ccc(NC)nn2)cc1
InChIInChI=1S/C13H15N3O/c1-3-17-11-6-4-10(5-7-11)12-8-9-13(14-2)16-15-12/h4-9H,3H2,1-2H3,(H,14,16)
InChIKeyGWQQEMLEZZEANI-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.58
Rot. Bonds4

About 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine

6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine (PubChem CID 62203548) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine
PubChem CID62203548
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine
SMILESCCOc1ccc(-c2ccc(NC)nn2)cc1
InChIInChI=1S/C13H15N3O/c1-3-17-11-6-4-10(5-7-11)12-8-9-13(14-2)16-15-12/h4-9H,3H2,1-2H3,(H,14,16)
InChIKeyGWQQEMLEZZEANI-UHFFFAOYSA-N
XLogP2.58
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-(2-methoxyethoxy)phenyl]-N-methylpyridazin-3-amine
CID 98016971
N-methyl-6-[4-[(2-methylpropan-2-yl)oxy]phenyl]pyridazin-3-amine
CID 82483041
6-(4-ethoxyphenyl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80952608
4-(4-ethoxyphenyl)-N-methylaniline
CID 83643476
N'-[6-(4-propoxyphenyl)pyridazin-3-yl]propane-1,3-diamine
CID 82191585
3,6-bis(4-decoxyphenyl)pyridazine
CID 101171713
N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine
CID 116973158
3-(4-ethoxyphenyl)-6-piperazin-1-ylpyridazine
CID 52903948
6-(4-ethoxyphenyl)pyridin-3-amine
CID 79018845
5-bromo-2-(4-ethoxyphenyl)pyridine
CID 83920618
4-(4-ethoxyphenyl)selenadiazole
CID 4047770
6-(4-ethoxyphenyl)-2-methylpyridine-3-carbothioamide
CID 82453144

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine?
The IUPAC name of 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine (CID 62203548) is 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine.
What is the SMILES notation for 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine?
The canonical SMILES for 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine is CCOc1ccc(-c2ccc(NC)nn2)cc1.
What is the InChIKey of 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine?
The InChIKey is GWQQEMLEZZEANI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-3-17-11-6-4-10(5-7-11)12-8-9-13(14-2)16-15-12/h4-9H,3H2,1-2H3,(H,14,16).
What are the key properties of 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine?
6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine has a molecular weight of 229.28 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethoxyphenyl)-N-methylpyridazin-3-amine is sourced from PubChem (CID 62203548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).