2-cyclohexyl-3,6-dihydro-1H-pyridazine

C10H18N2 — CID 67710417

IUPAC2-cyclohexyl-3,6-dihydro-1H-pyridazine
SMILESC1=CCN(C2CCCCC2)NC1
InChIInChI=1S/C10H18N2/c1-2-6-10(7-3-1)12-9-5-4-8-11-12/h4-5,10-11H,1-3,6-9H2
InChIKeyPQMPKLBMQSSNKH-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.70
Rot. Bonds1

About 2-cyclohexyl-3,6-dihydro-1H-pyridazine

2-cyclohexyl-3,6-dihydro-1H-pyridazine (PubChem CID 67710417) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-cyclohexyl-3,6-dihydro-1H-pyridazine.

Molecular Properties

Compound Name2-cyclohexyl-3,6-dihydro-1H-pyridazine
PubChem CID67710417
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-cyclohexyl-3,6-dihydro-1H-pyridazine
SMILESC1=CCN(C2CCCCC2)NC1
InChIInChI=1S/C10H18N2/c1-2-6-10(7-3-1)12-9-5-4-8-11-12/h4-5,10-11H,1-3,6-9H2
InChIKeyPQMPKLBMQSSNKH-UHFFFAOYSA-N
XLogP1.70
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-3,6-dihydro-1H-pyridazine?
The IUPAC name of 2-cyclohexyl-3,6-dihydro-1H-pyridazine (CID 67710417) is 2-cyclohexyl-3,6-dihydro-1H-pyridazine.
What is the SMILES notation for 2-cyclohexyl-3,6-dihydro-1H-pyridazine?
The canonical SMILES for 2-cyclohexyl-3,6-dihydro-1H-pyridazine is C1=CCN(C2CCCCC2)NC1.
What is the InChIKey of 2-cyclohexyl-3,6-dihydro-1H-pyridazine?
The InChIKey is PQMPKLBMQSSNKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-2-6-10(7-3-1)12-9-5-4-8-11-12/h4-5,10-11H,1-3,6-9H2.
What are the key properties of 2-cyclohexyl-3,6-dihydro-1H-pyridazine?
2-cyclohexyl-3,6-dihydro-1H-pyridazine has a molecular weight of 166.27 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-3,6-dihydro-1H-pyridazine is sourced from PubChem (CID 67710417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).