6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine

C16H15N3O — CID 64690526

IUPAC6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine
SMILESNC1=NN=C(c2cccc(Oc3ccccc3)c2)CC1
InChIInChI=1S/C16H15N3O/c17-16-10-9-15(18-19-16)12-5-4-8-14(11-12)20-13-6-2-1-3-7-13/h1-8,11H,9-10H2,(H2,17,19)
InChIKeyRYBZURIUKLGIFC-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.33
Rot. Bonds3

About 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine

6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine (PubChem CID 64690526) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine.

Molecular Properties

Compound Name6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine
PubChem CID64690526
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine
SMILESNC1=NN=C(c2cccc(Oc3ccccc3)c2)CC1
InChIInChI=1S/C16H15N3O/c17-16-10-9-15(18-19-16)12-5-4-8-14(11-12)20-13-6-2-1-3-7-13/h1-8,11H,9-10H2,(H2,17,19)
InChIKeyRYBZURIUKLGIFC-UHFFFAOYSA-N
XLogP3.33
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine?
The IUPAC name of 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine (CID 64690526) is 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine.
What is the SMILES notation for 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine?
The canonical SMILES for 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine is NC1=NN=C(c2cccc(Oc3ccccc3)c2)CC1.
What is the InChIKey of 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine?
The InChIKey is RYBZURIUKLGIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c17-16-10-9-15(18-19-16)12-5-4-8-14(11-12)20-13-6-2-1-3-7-13/h1-8,11H,9-10H2,(H2,17,19).
What are the key properties of 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine?
6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine has a molecular weight of 265.32 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-phenoxyphenyl)-4,5-dihydropyridazin-3-amine is sourced from PubChem (CID 64690526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).