2,3,4,5,6-pentamethyl-1H-pyridazine

C9H16N2 — CID 67676786

IUPAC2,3,4,5,6-pentamethyl-1H-pyridazine
SMILESCC1=C(C)C(C)=C(C)N(C)N1
InChIInChI=1S/C9H16N2/c1-6-7(2)9(4)11(5)10-8(6)3/h10H,1-5H3
InChIKeyVKJNERLXQLSZRP-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.02
Rot. Bonds

About 2,3,4,5,6-pentamethyl-1H-pyridazine

2,3,4,5,6-pentamethyl-1H-pyridazine (PubChem CID 67676786) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 2,3,4,5,6-pentamethyl-1H-pyridazine.

Molecular Properties

Compound Name2,3,4,5,6-pentamethyl-1H-pyridazine
PubChem CID67676786
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name2,3,4,5,6-pentamethyl-1H-pyridazine
SMILESCC1=C(C)C(C)=C(C)N(C)N1
InChIInChI=1S/C9H16N2/c1-6-7(2)9(4)11(5)10-8(6)3/h10H,1-5H3
InChIKeyVKJNERLXQLSZRP-UHFFFAOYSA-N
XLogP2.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3,4,5,6-pentamethyl-1H-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 2,3,4,5,6-pentamethyl-1H-pyridazine?
The IUPAC name of 2,3,4,5,6-pentamethyl-1H-pyridazine (CID 67676786) is 2,3,4,5,6-pentamethyl-1H-pyridazine.
What is the SMILES notation for 2,3,4,5,6-pentamethyl-1H-pyridazine?
The canonical SMILES for 2,3,4,5,6-pentamethyl-1H-pyridazine is CC1=C(C)C(C)=C(C)N(C)N1.
What is the InChIKey of 2,3,4,5,6-pentamethyl-1H-pyridazine?
The InChIKey is VKJNERLXQLSZRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-6-7(2)9(4)11(5)10-8(6)3/h10H,1-5H3.
What are the key properties of 2,3,4,5,6-pentamethyl-1H-pyridazine?
2,3,4,5,6-pentamethyl-1H-pyridazine has a molecular weight of 152.24 g/mol, XLogP of 2.02, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5,6-pentamethyl-1H-pyridazine is sourced from PubChem (CID 67676786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).