6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine

C12H18N6O — CID 146128446

IUPAC6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine
SMILESCCOC1(C)CCN(c2ccc3nnnn3n2)CC1
InChIInChI=1S/C12H18N6O/c1-3-19-12(2)6-8-17(9-7-12)11-5-4-10-13-15-16-18(10)14-11/h4-5H,3,6-9H2,1-2H3
InChIKeySSOJLKAYEPVYKZ-UHFFFAOYSA-N
MW262.32 g/mol
LogP0.91
Rot. Bonds3

About 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine

6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine (PubChem CID 146128446) has the molecular formula C12H18N6O and a molecular weight of 262.32 g/mol. Its IUPAC name is 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine.

Molecular Properties

Compound Name6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine
PubChem CID146128446
Molecular FormulaC12H18N6O
Molecular Weight262.32 g/mol
Exact Mass262.15
IUPAC Name6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine
SMILESCCOC1(C)CCN(c2ccc3nnnn3n2)CC1
InChIInChI=1S/C12H18N6O/c1-3-19-12(2)6-8-17(9-7-12)11-5-4-10-13-15-16-18(10)14-11/h4-5H,3,6-9H2,1-2H3
InChIKeySSOJLKAYEPVYKZ-UHFFFAOYSA-N
XLogP0.91
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine?
The IUPAC name of 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine (CID 146128446) is 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine.
What is the SMILES notation for 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine?
The canonical SMILES for 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine is CCOC1(C)CCN(c2ccc3nnnn3n2)CC1.
What is the InChIKey of 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine?
The InChIKey is SSOJLKAYEPVYKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O/c1-3-19-12(2)6-8-17(9-7-12)11-5-4-10-13-15-16-18(10)14-11/h4-5H,3,6-9H2,1-2H3.
What are the key properties of 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine?
6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine has a molecular weight of 262.32 g/mol, XLogP of 0.91, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethoxy-4-methylpiperidin-1-yl)tetrazolo[1,5-b]pyridazine is sourced from PubChem (CID 146128446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).