6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine

C15H19N3O2 — CID 82793961

IUPAC6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine
SMILESCNc1nnc(-c2cccc(OC)c2OC)c(C)c1C
InChIInChI=1S/C15H19N3O2/c1-9-10(2)15(16-3)18-17-13(9)11-7-6-8-12(19-4)14(11)20-5/h6-8H,1-5H3,(H,16,18)
InChIKeyZHCSRTFXODACJB-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.82
Rot. Bonds4

About 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine

6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine (PubChem CID 82793961) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine
PubChem CID82793961
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine
SMILESCNc1nnc(-c2cccc(OC)c2OC)c(C)c1C
InChIInChI=1S/C15H19N3O2/c1-9-10(2)15(16-3)18-17-13(9)11-7-6-8-12(19-4)14(11)20-5/h6-8H,1-5H3,(H,16,18)
InChIKeyZHCSRTFXODACJB-UHFFFAOYSA-N
XLogP2.82
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine?
The IUPAC name of 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine (CID 82793961) is 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine.
What is the SMILES notation for 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine?
The canonical SMILES for 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine is CNc1nnc(-c2cccc(OC)c2OC)c(C)c1C.
What is the InChIKey of 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine?
The InChIKey is ZHCSRTFXODACJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-9-10(2)15(16-3)18-17-13(9)11-7-6-8-12(19-4)14(11)20-5/h6-8H,1-5H3,(H,16,18).
What are the key properties of 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine?
6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine has a molecular weight of 273.34 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dimethoxyphenyl)-N,4,5-trimethylpyridazin-3-amine is sourced from PubChem (CID 82793961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).