6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine

C15H19N3O — CID 64691570

IUPAC6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine
SMILESCC1CC(N)=NN=C1c1cccc2c1OC(C)(C)C2
InChIInChI=1S/C15H19N3O/c1-9-7-12(16)17-18-13(9)11-6-4-5-10-8-15(2,3)19-14(10)11/h4-6,9H,7-8H2,1-3H3,(H2,16,17)
InChIKeyFGDHRJVSIRVVBH-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.50
Rot. Bonds1

About 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine

6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine (PubChem CID 64691570) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine.

Molecular Properties

Compound Name6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine
PubChem CID64691570
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine
SMILESCC1CC(N)=NN=C1c1cccc2c1OC(C)(C)C2
InChIInChI=1S/C15H19N3O/c1-9-7-12(16)17-18-13(9)11-6-4-5-10-8-15(2,3)19-14(10)11/h4-6,9H,7-8H2,1-3H3,(H2,16,17)
InChIKeyFGDHRJVSIRVVBH-UHFFFAOYSA-N
XLogP2.50
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine?
The IUPAC name of 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine (CID 64691570) is 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine.
What is the SMILES notation for 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine?
The canonical SMILES for 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine is CC1CC(N)=NN=C1c1cccc2c1OC(C)(C)C2.
What is the InChIKey of 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine?
The InChIKey is FGDHRJVSIRVVBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-9-7-12(16)17-18-13(9)11-6-4-5-10-8-15(2,3)19-14(10)11/h4-6,9H,7-8H2,1-3H3,(H2,16,17).
What are the key properties of 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine?
6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine has a molecular weight of 257.34 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-methyl-4,5-dihydropyridazin-3-amine is sourced from PubChem (CID 64691570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).