4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine

C19H20N6 — CID 150540546

IUPAC4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine
SMILESCc1cc(-c2ccccc2)nnc1N1CCN(c2ccncn2)CC1
InChIInChI=1S/C19H20N6/c1-15-13-17(16-5-3-2-4-6-16)22-23-19(15)25-11-9-24(10-12-25)18-7-8-20-14-21-18/h2-8,13-14H,9-12H2,1H3
InChIKeyIFTWXPKEWYOILZ-UHFFFAOYSA-N
MW332.41 g/mol
LogP2.57
Rot. Bonds3

About 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine

4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine (PubChem CID 150540546) has the molecular formula C19H20N6 and a molecular weight of 332.41 g/mol. Its IUPAC name is 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine.

Molecular Properties

Compound Name4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine
PubChem CID150540546
Molecular FormulaC19H20N6
Molecular Weight332.41 g/mol
Exact Mass332.17
IUPAC Name4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine
SMILESCc1cc(-c2ccccc2)nnc1N1CCN(c2ccncn2)CC1
InChIInChI=1S/C19H20N6/c1-15-13-17(16-5-3-2-4-6-16)22-23-19(15)25-11-9-24(10-12-25)18-7-8-20-14-21-18/h2-8,13-14H,9-12H2,1H3
InChIKeyIFTWXPKEWYOILZ-UHFFFAOYSA-N
XLogP2.57
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-3-(4-methylpiperazin-1-yl)-6-phenylpyridazine
CID 13218685
4-methyl-6-pyridin-3-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine
CID 71449666
4,6-diphenyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine
CID 23628246
6-phenyl-4-pyridin-4-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine;hydrobromide;hydrochloride
CID 54759860
3-(4-methylphenyl)-6-[4-(6-phenylpyrimidin-4-yl)piperazin-1-yl]pyridazine
CID 108775200
3,4-dimethyl-6-phenylpyridazine
CID 14040320
4-(4-pyrimidin-4-ylpiperazin-1-yl)pyrazolo[1,5-a]pyrazine
CID 154830011
ethane;propane;4-pyrrolidin-1-ylpyrimidine
CID 156866865
4-phenyl-6-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyrimidine
CID 58273412
3-tert-butyl-6-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine
CID 139023230
7-fluoro-4-(4-pyrimidin-4-ylpiperazin-1-yl)quinazoline
CID 154830107
4-methyl-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]quinoline
CID 108777250

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine?
The IUPAC name of 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine (CID 150540546) is 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine.
What is the SMILES notation for 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine?
The canonical SMILES for 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine is Cc1cc(-c2ccccc2)nnc1N1CCN(c2ccncn2)CC1.
What is the InChIKey of 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine?
The InChIKey is IFTWXPKEWYOILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6/c1-15-13-17(16-5-3-2-4-6-16)22-23-19(15)25-11-9-24(10-12-25)18-7-8-20-14-21-18/h2-8,13-14H,9-12H2,1H3.
What are the key properties of 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine?
4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine has a molecular weight of 332.41 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-phenyl-3-(4-pyrimidin-4-ylpiperazin-1-yl)pyridazine is sourced from PubChem (CID 150540546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).