3,4,6-trimethyl-3,4-dihydropyridazine

C7H12N2 — CID 147051704

IUPAC3,4,6-trimethyl-3,4-dihydropyridazine
SMILESCC1=CC(C)C(C)N=N1
InChIInChI=1S/C7H12N2/c1-5-4-6(2)8-9-7(5)3/h4-5,7H,1-3H3
InChIKeyBBKYQMABUCEVLO-UHFFFAOYSA-N
MW124.19 g/mol
LogP2.38
Rot. Bonds

About 3,4,6-trimethyl-3,4-dihydropyridazine

3,4,6-trimethyl-3,4-dihydropyridazine (PubChem CID 147051704) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 3,4,6-trimethyl-3,4-dihydropyridazine.

Molecular Properties

Compound Name3,4,6-trimethyl-3,4-dihydropyridazine
PubChem CID147051704
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name3,4,6-trimethyl-3,4-dihydropyridazine
SMILESCC1=CC(C)C(C)N=N1
InChIInChI=1S/C7H12N2/c1-5-4-6(2)8-9-7(5)3/h4-5,7H,1-3H3
InChIKeyBBKYQMABUCEVLO-UHFFFAOYSA-N
XLogP2.38
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4,6-trimethyl-3,4-dihydropyridazine?
The IUPAC name of 3,4,6-trimethyl-3,4-dihydropyridazine (CID 147051704) is 3,4,6-trimethyl-3,4-dihydropyridazine.
What is the SMILES notation for 3,4,6-trimethyl-3,4-dihydropyridazine?
The canonical SMILES for 3,4,6-trimethyl-3,4-dihydropyridazine is CC1=CC(C)C(C)N=N1.
What is the InChIKey of 3,4,6-trimethyl-3,4-dihydropyridazine?
The InChIKey is BBKYQMABUCEVLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-5-4-6(2)8-9-7(5)3/h4-5,7H,1-3H3.
What are the key properties of 3,4,6-trimethyl-3,4-dihydropyridazine?
3,4,6-trimethyl-3,4-dihydropyridazine has a molecular weight of 124.19 g/mol, XLogP of 2.38, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,6-trimethyl-3,4-dihydropyridazine is sourced from PubChem (CID 147051704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).