3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine

C9H18N2 — CID 126728114

IUPAC3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine
SMILESCCC1C(C)C=C(C)NN1C
InChIInChI=1S/C9H18N2/c1-5-9-7(2)6-8(3)10-11(9)4/h6-7,9-10H,5H2,1-4H3
InChIKeyPCDLMPTUGGJHJG-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.75
Rot. Bonds1

About 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine

3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine (PubChem CID 126728114) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine.

Molecular Properties

Compound Name3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine
PubChem CID126728114
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine
SMILESCCC1C(C)C=C(C)NN1C
InChIInChI=1S/C9H18N2/c1-5-9-7(2)6-8(3)10-11(9)4/h6-7,9-10H,5H2,1-4H3
InChIKeyPCDLMPTUGGJHJG-UHFFFAOYSA-N
XLogP1.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine?
The IUPAC name of 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine (CID 126728114) is 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine.
What is the SMILES notation for 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine?
The canonical SMILES for 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine is CCC1C(C)C=C(C)NN1C.
What is the InChIKey of 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine?
The InChIKey is PCDLMPTUGGJHJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-5-9-7(2)6-8(3)10-11(9)4/h6-7,9-10H,5H2,1-4H3.
What are the key properties of 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine?
3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine has a molecular weight of 154.26 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,4,6-trimethyl-3,4-dihydro-1H-pyridazine is sourced from PubChem (CID 126728114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).