[(diphenylphosphanylamino)-phenylphosphanyl]benzene

C24H21NP2 — CID 621811

IUPAC[(diphenylphosphanylamino)-phenylphosphanyl]benzene
SMILESc1ccc(P(NP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H21NP2/c1-5-13-21(14-6-1)26(22-15-7-2-8-16-22)25-27(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25H
InChIKeyAVYXASMIUOIQII-UHFFFAOYSA-N
MW385.39 g/mol
LogP4.67
Rot. Bonds6

About [(diphenylphosphanylamino)-phenylphosphanyl]benzene

[(diphenylphosphanylamino)-phenylphosphanyl]benzene (PubChem CID 621811) has the molecular formula C24H21NP2 and a molecular weight of 385.39 g/mol. Its IUPAC name is [(diphenylphosphanylamino)-phenylphosphanyl]benzene.

Molecular Properties

Compound Name[(diphenylphosphanylamino)-phenylphosphanyl]benzene
PubChem CID621811
Molecular FormulaC24H21NP2
Molecular Weight385.39 g/mol
Exact Mass385.11
IUPAC Name[(diphenylphosphanylamino)-phenylphosphanyl]benzene
SMILESc1ccc(P(NP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H21NP2/c1-5-13-21(14-6-1)26(22-15-7-2-8-16-22)25-27(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25H
InChIKeyAVYXASMIUOIQII-UHFFFAOYSA-N
XLogP4.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.39
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(diphenylphosphanylamino)-phenylphosphanyl]benzene?
The IUPAC name of [(diphenylphosphanylamino)-phenylphosphanyl]benzene (CID 621811) is [(diphenylphosphanylamino)-phenylphosphanyl]benzene.
What is the SMILES notation for [(diphenylphosphanylamino)-phenylphosphanyl]benzene?
The canonical SMILES for [(diphenylphosphanylamino)-phenylphosphanyl]benzene is c1ccc(P(NP(c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [(diphenylphosphanylamino)-phenylphosphanyl]benzene?
The InChIKey is AVYXASMIUOIQII-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NP2/c1-5-13-21(14-6-1)26(22-15-7-2-8-16-22)25-27(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25H.
What are the key properties of [(diphenylphosphanylamino)-phenylphosphanyl]benzene?
[(diphenylphosphanylamino)-phenylphosphanyl]benzene has a molecular weight of 385.39 g/mol, XLogP of 4.67, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(diphenylphosphanylamino)-phenylphosphanyl]benzene is sourced from PubChem (CID 621811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).