4-tert-butyl-1-methyl-6-methylidenepyridazine

C10H16N2 — CID 167564376

IUPAC4-tert-butyl-1-methyl-6-methylidenepyridazine
SMILESC=C1C=C(C(C)(C)C)C=NN1C
InChIInChI=1S/C10H16N2/c1-8-6-9(10(2,3)4)7-11-12(8)5/h6-7H,1H2,2-5H3
InChIKeyYSBGGBWWJFCZMM-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.40
Rot. Bonds

About 4-tert-butyl-1-methyl-6-methylidenepyridazine

4-tert-butyl-1-methyl-6-methylidenepyridazine (PubChem CID 167564376) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 4-tert-butyl-1-methyl-6-methylidenepyridazine.

Molecular Properties

Compound Name4-tert-butyl-1-methyl-6-methylidenepyridazine
PubChem CID167564376
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name4-tert-butyl-1-methyl-6-methylidenepyridazine
SMILESC=C1C=C(C(C)(C)C)C=NN1C
InChIInChI=1S/C10H16N2/c1-8-6-9(10(2,3)4)7-11-12(8)5/h6-7H,1H2,2-5H3
InChIKeyYSBGGBWWJFCZMM-UHFFFAOYSA-N
XLogP2.40
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-tert-butyl-1-methyl-6-methylidenepyridazine 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-tert-butyl-1-methyl-6-methylidenepyridazine?
The IUPAC name of 4-tert-butyl-1-methyl-6-methylidenepyridazine (CID 167564376) is 4-tert-butyl-1-methyl-6-methylidenepyridazine.
What is the SMILES notation for 4-tert-butyl-1-methyl-6-methylidenepyridazine?
The canonical SMILES for 4-tert-butyl-1-methyl-6-methylidenepyridazine is C=C1C=C(C(C)(C)C)C=NN1C.
What is the InChIKey of 4-tert-butyl-1-methyl-6-methylidenepyridazine?
The InChIKey is YSBGGBWWJFCZMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8-6-9(10(2,3)4)7-11-12(8)5/h6-7H,1H2,2-5H3.
What are the key properties of 4-tert-butyl-1-methyl-6-methylidenepyridazine?
4-tert-butyl-1-methyl-6-methylidenepyridazine has a molecular weight of 164.25 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-1-methyl-6-methylidenepyridazine is sourced from PubChem (CID 167564376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).