3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine

C10H15ClN2O2 — CID 106447482

IUPAC3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine
SMILESCC(C)COCCOc1ccc(Cl)nn1
InChIInChI=1S/C10H15ClN2O2/c1-8(2)7-14-5-6-15-10-4-3-9(11)12-13-10/h3-4,8H,5-7H2,1-2H3
InChIKeyAPDZWVFBBSCIBX-UHFFFAOYSA-N
MW230.69 g/mol
LogP2.18
Rot. Bonds6

About 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine

3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine (PubChem CID 106447482) has the molecular formula C10H15ClN2O2 and a molecular weight of 230.69 g/mol. Its IUPAC name is 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine.

Molecular Properties

Compound Name3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine
PubChem CID106447482
Molecular FormulaC10H15ClN2O2
Molecular Weight230.69 g/mol
Exact Mass230.08
IUPAC Name3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine
SMILESCC(C)COCCOc1ccc(Cl)nn1
InChIInChI=1S/C10H15ClN2O2/c1-8(2)7-14-5-6-15-10-4-3-9(11)12-13-10/h3-4,8H,5-7H2,1-2H3
InChIKeyAPDZWVFBBSCIBX-UHFFFAOYSA-N
XLogP2.18
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.69
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine?
The IUPAC name of 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine (CID 106447482) is 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine.
What is the SMILES notation for 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine?
The canonical SMILES for 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine is CC(C)COCCOc1ccc(Cl)nn1.
What is the InChIKey of 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine?
The InChIKey is APDZWVFBBSCIBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O2/c1-8(2)7-14-5-6-15-10-4-3-9(11)12-13-10/h3-4,8H,5-7H2,1-2H3.
What are the key properties of 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine?
3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine has a molecular weight of 230.69 g/mol, XLogP of 2.18, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine is sourced from PubChem (CID 106447482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).