sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate

C14H31GeNNaO2P — CID 23693657

IUPACsodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate
SMILESCC[Ge](CC)(CC)CCP(=O)([O-])CN1CCCCC1.[Na+]
InChIInChI=1S/C14H32GeNO2P.Na/c1-4-15(5-2,6-3)10-13-19(17,18)14-16-11-8-7-9-12-16;/h4-14H2,1-3H3,(H,17,18);/q;+1/p-1
InChIKeyUQXMSTXKVFXTHA-UHFFFAOYSA-M
MW371.98 g/mol
LogP0.58
Rot. Bonds8

About sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate

sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate (PubChem CID 23693657) has the molecular formula C14H31GeNNaO2P and a molecular weight of 371.98 g/mol. Its IUPAC name is sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate.

Molecular Properties

Compound Namesodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate
PubChem CID23693657
Molecular FormulaC14H31GeNNaO2P
Molecular Weight371.98 g/mol
Exact Mass373.12
IUPAC Namesodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate
SMILESCC[Ge](CC)(CC)CCP(=O)([O-])CN1CCCCC1.[Na+]
InChIInChI=1S/C14H32GeNO2P.Na/c1-4-15(5-2,6-3)10-13-19(17,18)14-16-11-8-7-9-12-16;/h4-14H2,1-3H3,(H,17,18);/q;+1/p-1
InChIKeyUQXMSTXKVFXTHA-UHFFFAOYSA-M
XLogP0.58
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.98
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate?
The IUPAC name of sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate (CID 23693657) is sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate.
What is the SMILES notation for sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate?
The canonical SMILES for sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate is CC[Ge](CC)(CC)CCP(=O)([O-])CN1CCCCC1.[Na+].
What is the InChIKey of sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate?
The InChIKey is UQXMSTXKVFXTHA-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H32GeNO2P.Na/c1-4-15(5-2,6-3)10-13-19(17,18)14-16-11-8-7-9-12-16;/h4-14H2,1-3H3,(H,17,18);/q;+1/p-1.
What are the key properties of sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate?
sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate has a molecular weight of 371.98 g/mol, XLogP of 0.58, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium piperidin-1-ylmethyl(2-triethylgermylethyl)phosphinate is sourced from PubChem (CID 23693657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).