6-piperidin-4-yloxypyridazine-3-carbonitrile

C10H12N4O — CID 146286887

IUPAC6-piperidin-4-yloxypyridazine-3-carbonitrile
SMILESN#Cc1ccc(OC2CCNCC2)nn1
InChIInChI=1S/C10H12N4O/c11-7-8-1-2-10(14-13-8)15-9-3-5-12-6-4-9/h1-2,9,12H,3-6H2
InChIKeyITLLKLJUWNMTKU-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.48
Rot. Bonds2

About 6-piperidin-4-yloxypyridazine-3-carbonitrile

6-piperidin-4-yloxypyridazine-3-carbonitrile (PubChem CID 146286887) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 6-piperidin-4-yloxypyridazine-3-carbonitrile.

Molecular Properties

Compound Name6-piperidin-4-yloxypyridazine-3-carbonitrile
PubChem CID146286887
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name6-piperidin-4-yloxypyridazine-3-carbonitrile
SMILESN#Cc1ccc(OC2CCNCC2)nn1
InChIInChI=1S/C10H12N4O/c11-7-8-1-2-10(14-13-8)15-9-3-5-12-6-4-9/h1-2,9,12H,3-6H2
InChIKeyITLLKLJUWNMTKU-UHFFFAOYSA-N
XLogP0.48
TPSA70.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-piperidin-4-yloxypyridazine-3-carbonitrile?
The IUPAC name of 6-piperidin-4-yloxypyridazine-3-carbonitrile (CID 146286887) is 6-piperidin-4-yloxypyridazine-3-carbonitrile.
What is the SMILES notation for 6-piperidin-4-yloxypyridazine-3-carbonitrile?
The canonical SMILES for 6-piperidin-4-yloxypyridazine-3-carbonitrile is N#Cc1ccc(OC2CCNCC2)nn1.
What is the InChIKey of 6-piperidin-4-yloxypyridazine-3-carbonitrile?
The InChIKey is ITLLKLJUWNMTKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c11-7-8-1-2-10(14-13-8)15-9-3-5-12-6-4-9/h1-2,9,12H,3-6H2.
What are the key properties of 6-piperidin-4-yloxypyridazine-3-carbonitrile?
6-piperidin-4-yloxypyridazine-3-carbonitrile has a molecular weight of 204.23 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-4-yloxypyridazine-3-carbonitrile is sourced from PubChem (CID 146286887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).