2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline

C24H32NPSi2 — CID 87719008

IUPAC2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline
SMILESC[Si](C)(C)N(c1ccccc1P(c1ccccc1)c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C24H32NPSi2/c1-27(2,3)25(28(4,5)6)23-19-13-14-20-24(23)26(21-15-9-7-10-16-21)22-17-11-8-12-18-22/h7-20H,1-6H3
InChIKeyCNYIVOOOSMKGHD-UHFFFAOYSA-N
MW421.67 g/mol
LogP5.92
Rot. Bonds6

About 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline

2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline (PubChem CID 87719008) has the molecular formula C24H32NPSi2 and a molecular weight of 421.67 g/mol. Its IUPAC name is 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline.

Molecular Properties

Compound Name2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline
PubChem CID87719008
Molecular FormulaC24H32NPSi2
Molecular Weight421.67 g/mol
Exact Mass421.18
IUPAC Name2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline
SMILESC[Si](C)(C)N(c1ccccc1P(c1ccccc1)c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C24H32NPSi2/c1-27(2,3)25(28(4,5)6)23-19-13-14-20-24(23)26(21-15-9-7-10-16-21)22-17-11-8-12-18-22/h7-20H,1-6H3
InChIKeyCNYIVOOOSMKGHD-UHFFFAOYSA-N
XLogP5.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.67
LogP ≤ 55.92
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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Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline?
The IUPAC name of 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline (CID 87719008) is 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline.
What is the SMILES notation for 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline?
The canonical SMILES for 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline is C[Si](C)(C)N(c1ccccc1P(c1ccccc1)c1ccccc1)[Si](C)(C)C.
What is the InChIKey of 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline?
The InChIKey is CNYIVOOOSMKGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32NPSi2/c1-27(2,3)25(28(4,5)6)23-19-13-14-20-24(23)26(21-15-9-7-10-16-21)22-17-11-8-12-18-22/h7-20H,1-6H3.
What are the key properties of 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline?
2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline has a molecular weight of 421.67 g/mol, XLogP of 5.92, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphanyl-N,N-bis(trimethylsilyl)aniline is sourced from PubChem (CID 87719008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).