bis(2-aminopropan-2-yloxy)-oxophosphanium

C6H16N2O3P+ — CID 87210634

IUPACbis(2-aminopropan-2-yloxy)-oxophosphanium
SMILESCC(C)(N)O[P+](=O)OC(C)(C)N
InChIInChI=1S/C6H16N2O3P/c1-5(2,7)10-12(9)11-6(3,4)8/h7-8H2,1-4H3/q+1
InChIKeyUJJDUWUQYNNDSR-UHFFFAOYSA-N
MW195.18 g/mol
LogP1.07
Rot. Bonds4

About bis(2-aminopropan-2-yloxy)-oxophosphanium

bis(2-aminopropan-2-yloxy)-oxophosphanium (PubChem CID 87210634) has the molecular formula C6H16N2O3P+ and a molecular weight of 195.18 g/mol. Its IUPAC name is bis(2-aminopropan-2-yloxy)-oxophosphanium.

Molecular Properties

Compound Namebis(2-aminopropan-2-yloxy)-oxophosphanium
PubChem CID87210634
Molecular FormulaC6H16N2O3P+
Molecular Weight195.18 g/mol
Exact Mass195.09
IUPAC Namebis(2-aminopropan-2-yloxy)-oxophosphanium
SMILESCC(C)(N)O[P+](=O)OC(C)(C)N
InChIInChI=1S/C6H16N2O3P/c1-5(2,7)10-12(9)11-6(3,4)8/h7-8H2,1-4H3/q+1
InChIKeyUJJDUWUQYNNDSR-UHFFFAOYSA-N
XLogP1.07
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

bis[(3-amino-1,5-dihydroxypentan-3-yl)oxy]-oxophosphanium
CID 57230640
bis(3-fluoropentan-3-yloxy)-oxophosphanium
CID 88634280
bis(1-amino-2-methyl-2-sulfanylpropoxy)-oxophosphanium
CID 56976746
2-aminopropan-2-yl 2-amino-2-methylpropanoate
CID 163435102
(1-amino-1-methoxysulfonylethyl)-oxido-oxophosphanium
CID 175164350
oxo-bis(5-propylnonan-5-yloxy)phosphanium
CID 87060248
CID 175795972
CID 175795972
tetrakis(2,2-dimethylpropane);bis(2-methylpropan-2-amine)
CID 159299187
bis(2-methylpropan-2-amine);dihydrochloride
CID 175186319
ethane;2-methylpropan-2-amine
CID 142052554
1-alumanylethane-1,1-diamine;phosphenous acid
CID 175267313
bis[3-(2-ethoxyethoxycarbonyl)pentan-3-yloxy]-oxophosphanium
CID 57099100

Frequently Asked Questions

What is the IUPAC name of bis(2-aminopropan-2-yloxy)-oxophosphanium?
The IUPAC name of bis(2-aminopropan-2-yloxy)-oxophosphanium (CID 87210634) is bis(2-aminopropan-2-yloxy)-oxophosphanium.
What is the SMILES notation for bis(2-aminopropan-2-yloxy)-oxophosphanium?
The canonical SMILES for bis(2-aminopropan-2-yloxy)-oxophosphanium is CC(C)(N)O[P+](=O)OC(C)(C)N.
What is the InChIKey of bis(2-aminopropan-2-yloxy)-oxophosphanium?
The InChIKey is UJJDUWUQYNNDSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2O3P/c1-5(2,7)10-12(9)11-6(3,4)8/h7-8H2,1-4H3/q+1.
What are the key properties of bis(2-aminopropan-2-yloxy)-oxophosphanium?
bis(2-aminopropan-2-yloxy)-oxophosphanium has a molecular weight of 195.18 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-aminopropan-2-yloxy)-oxophosphanium is sourced from PubChem (CID 87210634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).