2-ethyl-3-methyl-1H-pyridazine

C7H12N2 — CID 91489167

IUPAC2-ethyl-3-methyl-1H-pyridazine
SMILESCCN1NC=CC=C1C
InChIInChI=1S/C7H12N2/c1-3-9-7(2)5-4-6-8-9/h4-6,8H,3H2,1-2H3
InChIKeyRBQZCKSAPASZNP-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.24
Rot. Bonds1

About 2-ethyl-3-methyl-1H-pyridazine

2-ethyl-3-methyl-1H-pyridazine (PubChem CID 91489167) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 2-ethyl-3-methyl-1H-pyridazine.

Molecular Properties

Compound Name2-ethyl-3-methyl-1H-pyridazine
PubChem CID91489167
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name2-ethyl-3-methyl-1H-pyridazine
SMILESCCN1NC=CC=C1C
InChIInChI=1S/C7H12N2/c1-3-9-7(2)5-4-6-8-9/h4-6,8H,3H2,1-2H3
InChIKeyRBQZCKSAPASZNP-UHFFFAOYSA-N
XLogP1.24
TPSA15.27 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 ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-methyl-1H-pyridazine?
The IUPAC name of 2-ethyl-3-methyl-1H-pyridazine (CID 91489167) is 2-ethyl-3-methyl-1H-pyridazine.
What is the SMILES notation for 2-ethyl-3-methyl-1H-pyridazine?
The canonical SMILES for 2-ethyl-3-methyl-1H-pyridazine is CCN1NC=CC=C1C.
What is the InChIKey of 2-ethyl-3-methyl-1H-pyridazine?
The InChIKey is RBQZCKSAPASZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-3-9-7(2)5-4-6-8-9/h4-6,8H,3H2,1-2H3.
What are the key properties of 2-ethyl-3-methyl-1H-pyridazine?
2-ethyl-3-methyl-1H-pyridazine has a molecular weight of 124.19 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-methyl-1H-pyridazine is sourced from PubChem (CID 91489167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).