methyl(piperidin-1-yl)phosphinic acid

C6H14NO2P — CID 58071556

IUPACmethyl(piperidin-1-yl)phosphinic acid
SMILESCP(=O)(O)N1CCCCC1
InChIInChI=1S/C6H14NO2P/c1-10(8,9)7-5-3-2-4-6-7/h2-6H2,1H3,(H,8,9)
InChIKeyOOKSIGIYYHMKQC-UHFFFAOYSA-N
MW163.16 g/mol
LogP1.29
Rot. Bonds1

About methyl(piperidin-1-yl)phosphinic acid

methyl(piperidin-1-yl)phosphinic acid (PubChem CID 58071556) has the molecular formula C6H14NO2P and a molecular weight of 163.16 g/mol. Its IUPAC name is methyl(piperidin-1-yl)phosphinic acid.

Molecular Properties

Compound Namemethyl(piperidin-1-yl)phosphinic acid
PubChem CID58071556
Molecular FormulaC6H14NO2P
Molecular Weight163.16 g/mol
Exact Mass163.08
IUPAC Namemethyl(piperidin-1-yl)phosphinic acid
SMILESCP(=O)(O)N1CCCCC1
InChIInChI=1S/C6H14NO2P/c1-10(8,9)7-5-3-2-4-6-7/h2-6H2,1H3,(H,8,9)
InChIKeyOOKSIGIYYHMKQC-UHFFFAOYSA-N
XLogP1.29
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.16
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl(piperidin-1-yl)phosphinic acid?
The IUPAC name of methyl(piperidin-1-yl)phosphinic acid (CID 58071556) is methyl(piperidin-1-yl)phosphinic acid.
What is the SMILES notation for methyl(piperidin-1-yl)phosphinic acid?
The canonical SMILES for methyl(piperidin-1-yl)phosphinic acid is CP(=O)(O)N1CCCCC1.
What is the InChIKey of methyl(piperidin-1-yl)phosphinic acid?
The InChIKey is OOKSIGIYYHMKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14NO2P/c1-10(8,9)7-5-3-2-4-6-7/h2-6H2,1H3,(H,8,9).
What are the key properties of methyl(piperidin-1-yl)phosphinic acid?
methyl(piperidin-1-yl)phosphinic acid has a molecular weight of 163.16 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(piperidin-1-yl)phosphinic acid is sourced from PubChem (CID 58071556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).