trihydroxy(piperidin-1-yl)phosphanium

C5H13NO3P+ — CID 67615284

IUPACtrihydroxy(piperidin-1-yl)phosphanium
SMILESO[P+](O)(O)N1CCCCC1
InChIInChI=1S/C5H13NO3P/c7-10(8,9)6-4-2-1-3-5-6/h7-9H,1-5H2/q+1
InChIKeyBWUMRYTUAADGCH-UHFFFAOYSA-N
MW166.14 g/mol
LogP0.13
Rot. Bonds1

About trihydroxy(piperidin-1-yl)phosphanium

trihydroxy(piperidin-1-yl)phosphanium (PubChem CID 67615284) has the molecular formula C5H13NO3P+ and a molecular weight of 166.14 g/mol. Its IUPAC name is trihydroxy(piperidin-1-yl)phosphanium.

Molecular Properties

Compound Nametrihydroxy(piperidin-1-yl)phosphanium
PubChem CID67615284
Molecular FormulaC5H13NO3P+
Molecular Weight166.14 g/mol
Exact Mass166.06
IUPAC Nametrihydroxy(piperidin-1-yl)phosphanium
SMILESO[P+](O)(O)N1CCCCC1
InChIInChI=1S/C5H13NO3P/c7-10(8,9)6-4-2-1-3-5-6/h7-9H,1-5H2/q+1
InChIKeyBWUMRYTUAADGCH-UHFFFAOYSA-N
XLogP0.13
TPSA63.93 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.14
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trihydroxy(piperidin-1-yl)phosphanium?
The IUPAC name of trihydroxy(piperidin-1-yl)phosphanium (CID 67615284) is trihydroxy(piperidin-1-yl)phosphanium.
What is the SMILES notation for trihydroxy(piperidin-1-yl)phosphanium?
The canonical SMILES for trihydroxy(piperidin-1-yl)phosphanium is O[P+](O)(O)N1CCCCC1.
What is the InChIKey of trihydroxy(piperidin-1-yl)phosphanium?
The InChIKey is BWUMRYTUAADGCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO3P/c7-10(8,9)6-4-2-1-3-5-6/h7-9H,1-5H2/q+1.
What are the key properties of trihydroxy(piperidin-1-yl)phosphanium?
trihydroxy(piperidin-1-yl)phosphanium has a molecular weight of 166.14 g/mol, XLogP of 0.13, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy(piperidin-1-yl)phosphanium is sourced from PubChem (CID 67615284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).