[2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane

C32H34N2P2 — CID 85046658

IUPAC[2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane
SMILESc1ccc(P(c2ccccc2)N2CCCC2C2CCCN2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C32H34N2P2/c1-5-15-27(16-6-1)35(28-17-7-2-8-18-28)33-25-13-23-31(33)32-24-14-26-34(32)36(29-19-9-3-10-20-29)30-21-11-4-12-22-30/h1-12,15-22,31-32H,13-14,23-26H2
InChIKeyWSRPIPUKRNGFRJ-UHFFFAOYSA-N
MW508.59 g/mol
LogP6.01
Rot. Bonds7

About [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane

[2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane (PubChem CID 85046658) has the molecular formula C32H34N2P2 and a molecular weight of 508.59 g/mol. Its IUPAC name is [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane.

Molecular Properties

Compound Name[2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane
PubChem CID85046658
Molecular FormulaC32H34N2P2
Molecular Weight508.59 g/mol
Exact Mass508.22
IUPAC Name[2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane
SMILESc1ccc(P(c2ccccc2)N2CCCC2C2CCCN2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C32H34N2P2/c1-5-15-27(16-6-1)35(28-17-7-2-8-18-28)33-25-13-23-31(33)32-24-14-26-34(32)36(29-19-9-3-10-20-29)30-21-11-4-12-22-30/h1-12,15-22,31-32H,13-14,23-26H2
InChIKeyWSRPIPUKRNGFRJ-UHFFFAOYSA-N
XLogP6.01
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.59
LogP ≤ 56.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane?
The IUPAC name of [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane (CID 85046658) is [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane.
What is the SMILES notation for [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane?
The canonical SMILES for [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane is c1ccc(P(c2ccccc2)N2CCCC2C2CCCN2P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane?
The InChIKey is WSRPIPUKRNGFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34N2P2/c1-5-15-27(16-6-1)35(28-17-7-2-8-18-28)33-25-13-23-31(33)32-24-14-26-34(32)36(29-19-9-3-10-20-29)30-21-11-4-12-22-30/h1-12,15-22,31-32H,13-14,23-26H2.
What are the key properties of [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane?
[2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane has a molecular weight of 508.59 g/mol, XLogP of 6.01, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane is sourced from PubChem (CID 85046658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).