oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium

C20H40N2O3P+ — CID 15358025

IUPACoxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium
SMILESCN1C(C)(C)CC(O[P+](=O)OC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C20H40N2O3P/c1-17(2)11-15(12-18(3,4)21(17)9)24-26(23)25-16-13-19(5,6)22(10)20(7,8)14-16/h15-16H,11-14H2,1-10H3/q+1
InChIKeyAVKSVONPILOJHI-UHFFFAOYSA-N
MW387.53 g/mol
LogP4.98
Rot. Bonds4

About oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium

oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium (PubChem CID 15358025) has the molecular formula C20H40N2O3P+ and a molecular weight of 387.53 g/mol. Its IUPAC name is oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium.

Molecular Properties

Compound Nameoxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium
PubChem CID15358025
Molecular FormulaC20H40N2O3P+
Molecular Weight387.53 g/mol
Exact Mass387.28
IUPAC Nameoxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium
SMILESCN1C(C)(C)CC(O[P+](=O)OC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C20H40N2O3P/c1-17(2)11-15(12-18(3,4)21(17)9)24-26(23)25-16-13-19(5,6)22(10)20(7,8)14-16/h15-16H,11-14H2,1-10H3/q+1
InChIKeyAVKSVONPILOJHI-UHFFFAOYSA-N
XLogP4.98
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.53
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1,2,2,6,6-pentamethyl-4-sulfanyloxypiperidine
CID 169238949
(1,2,2,6,6-pentamethylpiperidin-4-yl) formate
CID 54067513
4-cyclopropyloxy-1,2,2,6,6-pentamethylpiperidine
CID 163909888
4-(methoxymethoxy)-1,2,2,6,6-pentamethylpiperidine
CID 59745303
(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-diazoacetate
CID 54185038
bis(1,2,2,6,6-pentamethylpiperidin-4-yl) tridecanedioate
CID 162454117
1,2,2,4,6,6-hexamethylpiperidine;(1,2,2,6,6-pentamethylpiperidin-4-yl) acetate
CID 158360818
bis(1,2,2,6,6-pentamethylpiperidin-4-yl) propanedioate;1-O-methyl 3-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) propanedioate
CID 163506972
(1,2,2,6,6-pentamethylpiperidin-4-yl) prop-2-enoate;(2,2,6,6-tetramethylpiperidin-4-yl) prop-2-enoate
CID 70486948
1-O-ethyl 4-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) but-2-enedioate
CID 54340280
1,2,2,4,6,6-hexamethylpiperidine;methane
CID 159576451
1,2,2,4,6,6-hexamethylpiperidine;vanadium
CID 159209902

Frequently Asked Questions

What is the IUPAC name of oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium?
The IUPAC name of oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium (CID 15358025) is oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium.
What is the SMILES notation for oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium?
The canonical SMILES for oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium is CN1C(C)(C)CC(O[P+](=O)OC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C.
What is the InChIKey of oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium?
The InChIKey is AVKSVONPILOJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40N2O3P/c1-17(2)11-15(12-18(3,4)21(17)9)24-26(23)25-16-13-19(5,6)22(10)20(7,8)14-16/h15-16H,11-14H2,1-10H3/q+1.
What are the key properties of oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium?
oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium has a molecular weight of 387.53 g/mol, XLogP of 4.98, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for oxo-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]phosphanium is sourced from PubChem (CID 15358025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).