3-phenylpyridazin-4-amine

C10H9N3 — CID 13068494

IUPAC3-phenylpyridazin-4-amine
SMILESNc1ccnnc1-c1ccccc1
InChIInChI=1S/C10H9N3/c11-9-6-7-12-13-10(9)8-4-2-1-3-5-8/h1-7H,(H2,11,12)
InChIKeyHVMZWEXKGOJZAF-UHFFFAOYSA-N
MW171.20 g/mol
LogP1.73
Rot. Bonds1

About 3-phenylpyridazin-4-amine

3-phenylpyridazin-4-amine (PubChem CID 13068494) has the molecular formula C10H9N3 and a molecular weight of 171.20 g/mol. Its IUPAC name is 3-phenylpyridazin-4-amine.

Molecular Properties

Compound Name3-phenylpyridazin-4-amine
PubChem CID13068494
Molecular FormulaC10H9N3
Molecular Weight171.20 g/mol
Exact Mass171.08
IUPAC Name3-phenylpyridazin-4-amine
SMILESNc1ccnnc1-c1ccccc1
InChIInChI=1S/C10H9N3/c11-9-6-7-12-13-10(9)8-4-2-1-3-5-8/h1-7H,(H2,11,12)
InChIKeyHVMZWEXKGOJZAF-UHFFFAOYSA-N
XLogP1.73
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-phenylpyridazin-4-amine?
The IUPAC name of 3-phenylpyridazin-4-amine (CID 13068494) is 3-phenylpyridazin-4-amine.
What is the SMILES notation for 3-phenylpyridazin-4-amine?
The canonical SMILES for 3-phenylpyridazin-4-amine is Nc1ccnnc1-c1ccccc1.
What is the InChIKey of 3-phenylpyridazin-4-amine?
The InChIKey is HVMZWEXKGOJZAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3/c11-9-6-7-12-13-10(9)8-4-2-1-3-5-8/h1-7H,(H2,11,12).
What are the key properties of 3-phenylpyridazin-4-amine?
3-phenylpyridazin-4-amine has a molecular weight of 171.20 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylpyridazin-4-amine is sourced from PubChem (CID 13068494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).