ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine

C9H20N2 — CID 156838752

IUPACethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine
SMILESCC.CCC1(C)CCN=NC1
InChIInChI=1S/C7H14N2.C2H6/c1-3-7(2)4-5-8-9-6-7;1-2/h3-6H2,1-2H3;1-2H3
InChIKeyBBWZHVLXILMZNF-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.28
Rot. Bonds1

About ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine

ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine (PubChem CID 156838752) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine.

Molecular Properties

Compound Nameethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine
PubChem CID156838752
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Nameethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine
SMILESCC.CCC1(C)CCN=NC1
InChIInChI=1S/C7H14N2.C2H6/c1-3-7(2)4-5-8-9-6-7;1-2/h3-6H2,1-2H3;1-2H3
InChIKeyBBWZHVLXILMZNF-UHFFFAOYSA-N
XLogP3.28
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine?
The IUPAC name of ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine (CID 156838752) is ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine.
What is the SMILES notation for ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine?
The canonical SMILES for ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine is CC.CCC1(C)CCN=NC1.
What is the InChIKey of ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine?
The InChIKey is BBWZHVLXILMZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.C2H6/c1-3-7(2)4-5-8-9-6-7;1-2/h3-6H2,1-2H3;1-2H3.
What are the key properties of ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine?
ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine has a molecular weight of 156.27 g/mol, XLogP of 3.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-ethyl-5-methyl-4,6-dihydro-3H-pyridazine is sourced from PubChem (CID 156838752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).