[[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide

C11H33B2NP2 — CID 158669253

IUPAC[[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide
SMILES[BH3-][P+](C)(N(C)[P+]([BH3-])(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C11H33B2NP2/c1-10(2,3)15(8,12)14(7)16(9,13)11(4,5)6/h1-9,12-13H3
InChIKeyUNKZKSFKTIIOOV-UHFFFAOYSA-N
MW262.96 g/mol
LogP2.20
Rot. Bonds2

About [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide

[[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide (PubChem CID 158669253) has the molecular formula C11H33B2NP2 and a molecular weight of 262.96 g/mol. Its IUPAC name is [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide.

Molecular Properties

Compound Name[[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide
PubChem CID158669253
Molecular FormulaC11H33B2NP2
Molecular Weight262.96 g/mol
Exact Mass263.23
IUPAC Name[[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide
SMILES[BH3-][P+](C)(N(C)[P+]([BH3-])(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C11H33B2NP2/c1-10(2,3)15(8,12)14(7)16(9,13)11(4,5)6/h1-9,12-13H3
InChIKeyUNKZKSFKTIIOOV-UHFFFAOYSA-N
XLogP2.20
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.96
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-hydroxy-3-methylbutan-2-olate
CID 59952741
[(boranuidyl-tert-butyl-methylphosphaniumyl)methyl-ditert-butylphosphaniumyl]boranuide
CID 99770819
3,3-dimethylbutan-2-ylphosphane
CID 57029329
N,N-dimethylmethanamine;2,3,4-trimethylpentan-3-amine
CID 87751828
4-(dimethylamino)-3,5,5-trimethylhexanoic acid
CID 116908129
N-tert-butyl-N-[dimethoxy(propan-2-yl)silyl]-2-methylpropan-2-amine
CID 87082076
3-(dimethylamino)-3-methylbutan-2-ol
CID 59861746
5-fluoro-2,3,3,4-tetramethylhexane
CID 170059541
1-(2,3-dimethylbutan-2-yl)-1-methylhydrazine
CID 166768392
N,N-ditert-butyl-2-methylpropan-1-amine
CID 18314178
N,N-dimethylmethanamine;3-ethyl-3-methylpentane;methane;3-methylpentane;2-methylpropane
CID 158967463
N,N,2,4,6,6,7,7-octamethyloctan-2-amine
CID 166808428

Frequently Asked Questions

What is the IUPAC name of [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide?
The IUPAC name of [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide (CID 158669253) is [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide.
What is the SMILES notation for [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide?
The canonical SMILES for [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide is [BH3-][P+](C)(N(C)[P+]([BH3-])(C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide?
The InChIKey is UNKZKSFKTIIOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H33B2NP2/c1-10(2,3)15(8,12)14(7)16(9,13)11(4,5)6/h1-9,12-13H3.
What are the key properties of [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide?
[[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide has a molecular weight of 262.96 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [[(boranuidyl-tert-butyl-methylphosphaniumyl)-methylamino]-tert-butyl-methylphosphaniumyl]boranuide is sourced from PubChem (CID 158669253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).