6-phenylpyridazin-4-amine

C10H9N3 — CID 13068495

IUPAC6-phenylpyridazin-4-amine
SMILESNc1cnnc(-c2ccccc2)c1
InChIInChI=1S/C10H9N3/c11-9-6-10(13-12-7-9)8-4-2-1-3-5-8/h1-7H,(H2,11,13)
InChIKeyGOPYZTXIZHSDJR-UHFFFAOYSA-N
MW171.20 g/mol
LogP1.73
Rot. Bonds1

About 6-phenylpyridazin-4-amine

6-phenylpyridazin-4-amine (PubChem CID 13068495) has the molecular formula C10H9N3 and a molecular weight of 171.20 g/mol. Its IUPAC name is 6-phenylpyridazin-4-amine.

Molecular Properties

Compound Name6-phenylpyridazin-4-amine
PubChem CID13068495
Molecular FormulaC10H9N3
Molecular Weight171.20 g/mol
Exact Mass171.08
IUPAC Name6-phenylpyridazin-4-amine
SMILESNc1cnnc(-c2ccccc2)c1
InChIInChI=1S/C10H9N3/c11-9-6-10(13-12-7-9)8-4-2-1-3-5-8/h1-7H,(H2,11,13)
InChIKeyGOPYZTXIZHSDJR-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 6-phenylpyridazin-4-amine?
The IUPAC name of 6-phenylpyridazin-4-amine (CID 13068495) is 6-phenylpyridazin-4-amine.
What is the SMILES notation for 6-phenylpyridazin-4-amine?
The canonical SMILES for 6-phenylpyridazin-4-amine is Nc1cnnc(-c2ccccc2)c1.
What is the InChIKey of 6-phenylpyridazin-4-amine?
The InChIKey is GOPYZTXIZHSDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3/c11-9-6-10(13-12-7-9)8-4-2-1-3-5-8/h1-7H,(H2,11,13).
What are the key properties of 6-phenylpyridazin-4-amine?
6-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 6-phenylpyridazin-4-amine is sourced from PubChem (CID 13068495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).