3,3-dimethyl-6-methylidenepyridazine

C7H10N2 — CID 142074095

IUPAC3,3-dimethyl-6-methylidenepyridazine
SMILESC=C1C=CC(C)(C)N=N1
InChIInChI=1S/C7H10N2/c1-6-4-5-7(2,3)9-8-6/h4-5H,1H2,2-3H3
InChIKeyXOISDCBXUZDRJI-UHFFFAOYSA-N
MW122.17 g/mol
LogP2.30
Rot. Bonds

About 3,3-dimethyl-6-methylidenepyridazine

3,3-dimethyl-6-methylidenepyridazine (PubChem CID 142074095) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 3,3-dimethyl-6-methylidenepyridazine.

Molecular Properties

Compound Name3,3-dimethyl-6-methylidenepyridazine
PubChem CID142074095
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name3,3-dimethyl-6-methylidenepyridazine
SMILESC=C1C=CC(C)(C)N=N1
InChIInChI=1S/C7H10N2/c1-6-4-5-7(2,3)9-8-6/h4-5H,1H2,2-3H3
InChIKeyXOISDCBXUZDRJI-UHFFFAOYSA-N
XLogP2.30
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-6-methylidenepyridazine?
The IUPAC name of 3,3-dimethyl-6-methylidenepyridazine (CID 142074095) is 3,3-dimethyl-6-methylidenepyridazine.
What is the SMILES notation for 3,3-dimethyl-6-methylidenepyridazine?
The canonical SMILES for 3,3-dimethyl-6-methylidenepyridazine is C=C1C=CC(C)(C)N=N1.
What is the InChIKey of 3,3-dimethyl-6-methylidenepyridazine?
The InChIKey is XOISDCBXUZDRJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-6-4-5-7(2,3)9-8-6/h4-5H,1H2,2-3H3.
What are the key properties of 3,3-dimethyl-6-methylidenepyridazine?
3,3-dimethyl-6-methylidenepyridazine has a molecular weight of 122.17 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-6-methylidenepyridazine is sourced from PubChem (CID 142074095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).