4,5-dimethyl-3,6-di(propan-2-yl)pyridazine

C12H20N2 — CID 58119422

IUPAC4,5-dimethyl-3,6-di(propan-2-yl)pyridazine
SMILESCc1c(C(C)C)nnc(C(C)C)c1C
InChIInChI=1S/C12H20N2/c1-7(2)11-9(5)10(6)12(8(3)4)14-13-11/h7-8H,1-6H3
InChIKeyZBWRLNLCKXVWQQ-UHFFFAOYSA-N
MW192.31 g/mol
LogP3.34
Rot. Bonds2

About 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine

4,5-dimethyl-3,6-di(propan-2-yl)pyridazine (PubChem CID 58119422) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine.

Molecular Properties

Compound Name4,5-dimethyl-3,6-di(propan-2-yl)pyridazine
PubChem CID58119422
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name4,5-dimethyl-3,6-di(propan-2-yl)pyridazine
SMILESCc1c(C(C)C)nnc(C(C)C)c1C
InChIInChI=1S/C12H20N2/c1-7(2)11-9(5)10(6)12(8(3)4)14-13-11/h7-8H,1-6H3
InChIKeyZBWRLNLCKXVWQQ-UHFFFAOYSA-N
XLogP3.34
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4,5-dimethyl-3,6-di(propan-2-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

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine?
The IUPAC name of 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine (CID 58119422) is 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine.
What is the SMILES notation for 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine?
The canonical SMILES for 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine is Cc1c(C(C)C)nnc(C(C)C)c1C.
What is the InChIKey of 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine?
The InChIKey is ZBWRLNLCKXVWQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-7(2)11-9(5)10(6)12(8(3)4)14-13-11/h7-8H,1-6H3.
What are the key properties of 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine?
4,5-dimethyl-3,6-di(propan-2-yl)pyridazine has a molecular weight of 192.31 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-3,6-di(propan-2-yl)pyridazine is sourced from PubChem (CID 58119422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).