3,4-dimethyl-6-phenylpyridazine

C12H12N2 — CID 14040320

IUPAC3,4-dimethyl-6-phenylpyridazine
SMILESCc1cc(-c2ccccc2)nnc1C
InChIInChI=1S/C12H12N2/c1-9-8-12(14-13-10(9)2)11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKeyRGTVJYNEHSIALD-UHFFFAOYSA-N
MW184.24 g/mol
LogP2.76
Rot. Bonds1

About 3,4-dimethyl-6-phenylpyridazine

3,4-dimethyl-6-phenylpyridazine (PubChem CID 14040320) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 3,4-dimethyl-6-phenylpyridazine.

Molecular Properties

Compound Name3,4-dimethyl-6-phenylpyridazine
PubChem CID14040320
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC Name3,4-dimethyl-6-phenylpyridazine
SMILESCc1cc(-c2ccccc2)nnc1C
InChIInChI=1S/C12H12N2/c1-9-8-12(14-13-10(9)2)11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKeyRGTVJYNEHSIALD-UHFFFAOYSA-N
XLogP2.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-6-phenylpyridazine?
The IUPAC name of 3,4-dimethyl-6-phenylpyridazine (CID 14040320) is 3,4-dimethyl-6-phenylpyridazine.
What is the SMILES notation for 3,4-dimethyl-6-phenylpyridazine?
The canonical SMILES for 3,4-dimethyl-6-phenylpyridazine is Cc1cc(-c2ccccc2)nnc1C.
What is the InChIKey of 3,4-dimethyl-6-phenylpyridazine?
The InChIKey is RGTVJYNEHSIALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2/c1-9-8-12(14-13-10(9)2)11-6-4-3-5-7-11/h3-8H,1-2H3.
What are the key properties of 3,4-dimethyl-6-phenylpyridazine?
3,4-dimethyl-6-phenylpyridazine has a molecular weight of 184.24 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-6-phenylpyridazine is sourced from PubChem (CID 14040320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).