[1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol

C11H17N3O — CID 106550352

IUPAC[1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol
SMILESCc1cnnc(N2CCCCC2CO)c1
InChIInChI=1S/C11H17N3O/c1-9-6-11(13-12-7-9)14-5-3-2-4-10(14)8-15/h6-7,10,15H,2-5,8H2,1H3
InChIKeyGCEHUHIHOKDUQY-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.14
Rot. Bonds2

About [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol

[1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol (PubChem CID 106550352) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol
PubChem CID106550352
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name[1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol
SMILESCc1cnnc(N2CCCCC2CO)c1
InChIInChI=1S/C11H17N3O/c1-9-6-11(13-12-7-9)14-5-3-2-4-10(14)8-15/h6-7,10,15H,2-5,8H2,1H3
InChIKeyGCEHUHIHOKDUQY-UHFFFAOYSA-N
XLogP1.14
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol?
The IUPAC name of [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol (CID 106550352) is [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol is Cc1cnnc(N2CCCCC2CO)c1.
What is the InChIKey of [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol?
The InChIKey is GCEHUHIHOKDUQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9-6-11(13-12-7-9)14-5-3-2-4-10(14)8-15/h6-7,10,15H,2-5,8H2,1H3.
What are the key properties of [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol?
[1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol has a molecular weight of 207.28 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methylpyridazin-3-yl)piperidin-2-yl]methanol is sourced from PubChem (CID 106550352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).