3-(4-methylphenyl)-6-phenylpyridazine

C17H14N2 — CID 6408779

IUPAC3-(4-methylphenyl)-6-phenylpyridazine
SMILESCc1ccc(-c2ccc(-c3ccccc3)nn2)cc1
InChIInChI=1S/C17H14N2/c1-13-7-9-15(10-8-13)17-12-11-16(18-19-17)14-5-3-2-4-6-14/h2-12H,1H3
InChIKeyBRESVLAAPCHGQH-UHFFFAOYSA-N
MW246.31 g/mol
LogP4.12
Rot. Bonds2

About 3-(4-methylphenyl)-6-phenylpyridazine

3-(4-methylphenyl)-6-phenylpyridazine (PubChem CID 6408779) has the molecular formula C17H14N2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 3-(4-methylphenyl)-6-phenylpyridazine.

Molecular Properties

Compound Name3-(4-methylphenyl)-6-phenylpyridazine
PubChem CID6408779
Molecular FormulaC17H14N2
Molecular Weight246.31 g/mol
Exact Mass246.12
IUPAC Name3-(4-methylphenyl)-6-phenylpyridazine
SMILESCc1ccc(-c2ccc(-c3ccccc3)nn2)cc1
InChIInChI=1S/C17H14N2/c1-13-7-9-15(10-8-13)17-12-11-16(18-19-17)14-5-3-2-4-6-14/h2-12H,1H3
InChIKeyBRESVLAAPCHGQH-UHFFFAOYSA-N
XLogP4.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-6-phenylpyridazine?
The IUPAC name of 3-(4-methylphenyl)-6-phenylpyridazine (CID 6408779) is 3-(4-methylphenyl)-6-phenylpyridazine.
What is the SMILES notation for 3-(4-methylphenyl)-6-phenylpyridazine?
The canonical SMILES for 3-(4-methylphenyl)-6-phenylpyridazine is Cc1ccc(-c2ccc(-c3ccccc3)nn2)cc1.
What is the InChIKey of 3-(4-methylphenyl)-6-phenylpyridazine?
The InChIKey is BRESVLAAPCHGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2/c1-13-7-9-15(10-8-13)17-12-11-16(18-19-17)14-5-3-2-4-6-14/h2-12H,1H3.
What are the key properties of 3-(4-methylphenyl)-6-phenylpyridazine?
3-(4-methylphenyl)-6-phenylpyridazine has a molecular weight of 246.31 g/mol, XLogP of 4.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-6-phenylpyridazine is sourced from PubChem (CID 6408779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).