5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine

C13H16FN3O — CID 65101175

IUPAC5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine
SMILESCCC1CC(N)=NN=C1c1ccc(OC)c(F)c1
InChIInChI=1S/C13H16FN3O/c1-3-8-7-12(15)16-17-13(8)9-4-5-11(18-2)10(14)6-9/h4-6,8H,3,7H2,1-2H3,(H2,15,16)
InChIKeyKAFONIDINBCYIA-UHFFFAOYSA-N
MW249.29 g/mol
LogP2.33
Rot. Bonds3

About 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine

5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine (PubChem CID 65101175) has the molecular formula C13H16FN3O and a molecular weight of 249.29 g/mol. Its IUPAC name is 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine.

Molecular Properties

Compound Name5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine
PubChem CID65101175
Molecular FormulaC13H16FN3O
Molecular Weight249.29 g/mol
Exact Mass249.13
IUPAC Name5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine
SMILESCCC1CC(N)=NN=C1c1ccc(OC)c(F)c1
InChIInChI=1S/C13H16FN3O/c1-3-8-7-12(15)16-17-13(8)9-4-5-11(18-2)10(14)6-9/h4-6,8H,3,7H2,1-2H3,(H2,15,16)
InChIKeyKAFONIDINBCYIA-UHFFFAOYSA-N
XLogP2.33
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.29
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-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

Related Compounds

2-ethyl-5,6-bis(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-one
CID 165389188
5-(3-fluoro-4-methoxyphenyl)pyrimidin-2-amine
CID 57445392
2-(3-fluoro-4-methoxyphenyl)pyrimidine
CID 134263784
1,2-difluoro-4-(3-fluoro-4-methoxyphenyl)benzene
CID 18930756
6-ethyl-2-(3-fluoro-4-methoxyphenyl)pyrimidin-4-amine
CID 65096029
6-[4-(difluoromethoxy)-3-ethoxyphenyl]-5-methyl-4,5-dihydropyridazin-3-amine
CID 64690125
5-bromo-2-(3-fluoro-4-methoxyphenyl)-6-propylpyrimidin-4-amine
CID 66295747
3-ethyl-5-(3-fluoro-4-methoxyphenyl)imidazol-4-amine
CID 65096261
2-ethyl-5-(3-fluoro-4-methoxyphenyl)-3-methylimidazol-4-amine
CID 65096550
3-ethyl-5-(3-fluoro-4-methoxyphenyl)-2-methylimidazol-4-amine
CID 65096402
5-amino-3-(3-fluoro-4-methoxyphenyl)-1-prop-2-enylpyrazole-4-carbaldehyde
CID 82361059
[(2S)-7-(3-fluoro-4-methoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 95229130

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine?
The IUPAC name of 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine (CID 65101175) is 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine.
What is the SMILES notation for 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine?
The canonical SMILES for 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine is CCC1CC(N)=NN=C1c1ccc(OC)c(F)c1.
What is the InChIKey of 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine?
The InChIKey is KAFONIDINBCYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3O/c1-3-8-7-12(15)16-17-13(8)9-4-5-11(18-2)10(14)6-9/h4-6,8H,3,7H2,1-2H3,(H2,15,16).
What are the key properties of 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine?
5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine has a molecular weight of 249.29 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-(3-fluoro-4-methoxyphenyl)-4,5-dihydropyridazin-3-amine is sourced from PubChem (CID 65101175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).