6-ethyl-6-methyl-1H-pyridazine

C7H12N2 — CID 173082589

IUPAC6-ethyl-6-methyl-1H-pyridazine
SMILESCCC1(C)C=CC=NN1
InChIInChI=1S/C7H12N2/c1-3-7(2)5-4-6-8-9-7/h4-6,9H,3H2,1-2H3
InChIKeyIODSUMGQGCPAPP-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.30
Rot. Bonds1

About 6-ethyl-6-methyl-1H-pyridazine

6-ethyl-6-methyl-1H-pyridazine (PubChem CID 173082589) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 6-ethyl-6-methyl-1H-pyridazine.

Molecular Properties

Compound Name6-ethyl-6-methyl-1H-pyridazine
PubChem CID173082589
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name6-ethyl-6-methyl-1H-pyridazine
SMILESCCC1(C)C=CC=NN1
InChIInChI=1S/C7H12N2/c1-3-7(2)5-4-6-8-9-7/h4-6,9H,3H2,1-2H3
InChIKeyIODSUMGQGCPAPP-UHFFFAOYSA-N
XLogP1.30
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-6-methyl-1H-pyridazine?
The IUPAC name of 6-ethyl-6-methyl-1H-pyridazine (CID 173082589) is 6-ethyl-6-methyl-1H-pyridazine.
What is the SMILES notation for 6-ethyl-6-methyl-1H-pyridazine?
The canonical SMILES for 6-ethyl-6-methyl-1H-pyridazine is CCC1(C)C=CC=NN1.
What is the InChIKey of 6-ethyl-6-methyl-1H-pyridazine?
The InChIKey is IODSUMGQGCPAPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-3-7(2)5-4-6-8-9-7/h4-6,9H,3H2,1-2H3.
What are the key properties of 6-ethyl-6-methyl-1H-pyridazine?
6-ethyl-6-methyl-1H-pyridazine has a molecular weight of 124.19 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-6-methyl-1H-pyridazine is sourced from PubChem (CID 173082589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).