diphenyl(piperazin-1-yl)phosphane

C16H19N2P — CID 21328506

IUPACdiphenyl(piperazin-1-yl)phosphane
SMILESc1ccc(P(c2ccccc2)N2CCNCC2)cc1
InChIInChI=1S/C16H19N2P/c1-3-7-15(8-4-1)19(16-9-5-2-6-10-16)18-13-11-17-12-14-18/h1-10,17H,11-14H2
InChIKeyJVLAXAWYFGQTFP-UHFFFAOYSA-N
MW270.32 g/mol
LogP1.94
Rot. Bonds3

About diphenyl(piperazin-1-yl)phosphane

diphenyl(piperazin-1-yl)phosphane (PubChem CID 21328506) has the molecular formula C16H19N2P and a molecular weight of 270.32 g/mol. Its IUPAC name is diphenyl(piperazin-1-yl)phosphane.

Molecular Properties

Compound Namediphenyl(piperazin-1-yl)phosphane
PubChem CID21328506
Molecular FormulaC16H19N2P
Molecular Weight270.32 g/mol
Exact Mass270.13
IUPAC Namediphenyl(piperazin-1-yl)phosphane
SMILESc1ccc(P(c2ccccc2)N2CCNCC2)cc1
InChIInChI=1S/C16H19N2P/c1-3-7-15(8-4-1)19(16-9-5-2-6-10-16)18-13-11-17-12-14-18/h1-10,17H,11-14H2
InChIKeyJVLAXAWYFGQTFP-UHFFFAOYSA-N
XLogP1.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 51.94
H-Bond Donors ≤ 51
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 diphenyl(piperazin-1-yl)phosphane?
The IUPAC name of diphenyl(piperazin-1-yl)phosphane (CID 21328506) is diphenyl(piperazin-1-yl)phosphane.
What is the SMILES notation for diphenyl(piperazin-1-yl)phosphane?
The canonical SMILES for diphenyl(piperazin-1-yl)phosphane is c1ccc(P(c2ccccc2)N2CCNCC2)cc1.
What is the InChIKey of diphenyl(piperazin-1-yl)phosphane?
The InChIKey is JVLAXAWYFGQTFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N2P/c1-3-7-15(8-4-1)19(16-9-5-2-6-10-16)18-13-11-17-12-14-18/h1-10,17H,11-14H2.
What are the key properties of diphenyl(piperazin-1-yl)phosphane?
diphenyl(piperazin-1-yl)phosphane has a molecular weight of 270.32 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl(piperazin-1-yl)phosphane is sourced from PubChem (CID 21328506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).