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

C9H18N2 — CID 90965213

IUPAC2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine
SMILESCCN1NC(C)C=C(C)C1C
InChIInChI=1S/C9H18N2/c1-5-11-9(4)7(2)6-8(3)10-11/h6,8-10H,5H2,1-4H3
InChIKeyOVNGRGPROIAYHZ-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.55
Rot. Bonds1

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

2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine (PubChem CID 90965213) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine.

Molecular Properties

Compound Name2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine
PubChem CID90965213
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine
SMILESCCN1NC(C)C=C(C)C1C
InChIInChI=1S/C9H18N2/c1-5-11-9(4)7(2)6-8(3)10-11/h6,8-10H,5H2,1-4H3
InChIKeyOVNGRGPROIAYHZ-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-Dimethyl-1,2,3,6-tetrahydropyridazine
CID 143979789
1,6-Dimethyl-1,2,3,6-tetrahydropyridazine
CID 167530640
N-Ethyl-3,6-dihydro-1(2H)-pyridinamine
CID 19376029
6-[(1Z)-buta-1,3-dienyl]-5-methyl-2-propan-2-yl-3,4-dihydro-1H-pyridazine
CID 89468900
3-[(1Z)-buta-1,3-dienyl]-4-methyl-2-propan-2-yl-5,6-dihydro-1H-pyridazine
CID 89468902
N-(1,2,3,6-tetrahydropyridin-5-ylmethyl)propan-2-amine
CID 117125540
4-ethyl-N-methyl-3,6-dihydro-2H-pyridin-1-amine
CID 123255221
1,1-Bis(2-methylidenepent-3-enyl)-2-prop-2-enylhydrazine
CID 123543479
3-Methyl-2-(4-methylcyclohexa-2,4-dien-1-yl)-1,5-dihydropyrazole
CID 123632362
2-Methyl-1-(2-methylpropyl)-1-pent-3-en-2-ylhydrazine
CID 123663831
1,1-dimethyl-2-[(E)-3-methylpent-3-enyl]hydrazine
CID 138478264
4-ethyl-2-propan-2-yl-3,6-dihydro-1H-pyridazine
CID 138640921

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine?
The IUPAC name of 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine (CID 90965213) is 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine.
What is the SMILES notation for 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine?
The canonical SMILES for 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine is CCN1NC(C)C=C(C)C1C.
What is the InChIKey of 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine?
The InChIKey is OVNGRGPROIAYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-5-11-9(4)7(2)6-8(3)10-11/h6,8-10H,5H2,1-4H3.
What are the key properties of 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine?
2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine has a molecular weight of 154.26 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3,4,6-trimethyl-3,6-dihydro-1H-pyridazine is sourced from PubChem (CID 90965213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).