6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine

C14H17N3O2 — CID 62203038

IUPAC6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine
SMILESCCNc1ccc(-c2ccc(OC)cc2OC)nn1
InChIInChI=1S/C14H17N3O2/c1-4-15-14-8-7-12(16-17-14)11-6-5-10(18-2)9-13(11)19-3/h5-9H,4H2,1-3H3,(H,15,17)
InChIKeyOWJBRFJTQKOSCK-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.59
Rot. Bonds5

About 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine

6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine (PubChem CID 62203038) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine.

Molecular Properties

Compound Name6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine
PubChem CID62203038
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine
SMILESCCNc1ccc(-c2ccc(OC)cc2OC)nn1
InChIInChI=1S/C14H17N3O2/c1-4-15-14-8-7-12(16-17-14)11-6-5-10(18-2)9-13(11)19-3/h5-9H,4H2,1-3H3,(H,15,17)
InChIKeyOWJBRFJTQKOSCK-UHFFFAOYSA-N
XLogP2.59
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine?
The IUPAC name of 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine (CID 62203038) is 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine.
What is the SMILES notation for 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine?
The canonical SMILES for 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine is CCNc1ccc(-c2ccc(OC)cc2OC)nn1.
What is the InChIKey of 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine?
The InChIKey is OWJBRFJTQKOSCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-4-15-14-8-7-12(16-17-14)11-6-5-10(18-2)9-13(11)19-3/h5-9H,4H2,1-3H3,(H,15,17).
What are the key properties of 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine?
6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine has a molecular weight of 259.31 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethoxyphenyl)-N-ethylpyridazin-3-amine is sourced from PubChem (CID 62203038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).