2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine

C22H35N4P3 — CID 134906744

IUPAC2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine
SMILESCN(C)P1(N(C)C)=CP(N(C)C)(N(C)C)=C1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H35N4P3/c1-23(2)28(24(3)4)19-29(25(5)6,26(7)8)22(28)27(20-15-11-9-12-16-20)21-17-13-10-14-18-21/h9-19H,1-8H3
InChIKeyXWBHRZWPJNSFTJ-UHFFFAOYSA-N
MW448.47 g/mol
LogP3.92
Rot. Bonds7

About 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine

2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine (PubChem CID 134906744) has the molecular formula C22H35N4P3 and a molecular weight of 448.47 g/mol. Its IUPAC name is 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine.

Molecular Properties

Compound Name2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine
PubChem CID134906744
Molecular FormulaC22H35N4P3
Molecular Weight448.47 g/mol
Exact Mass448.21
IUPAC Name2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine
SMILESCN(C)P1(N(C)C)=CP(N(C)C)(N(C)C)=C1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H35N4P3/c1-23(2)28(24(3)4)19-29(25(5)6,26(7)8)22(28)27(20-15-11-9-12-16-20)21-17-13-10-14-18-21/h9-19H,1-8H3
InChIKeyXWBHRZWPJNSFTJ-UHFFFAOYSA-N
XLogP3.92
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.47
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine with MolForge

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Related Compounds

Hydrazine, 1,1-bis(diphenylphosphino)-2,2-dimethyl-
CID 97350
[4-[Bis(dipropylamino)-propylphosphaniumyl]phenyl]-bis(dipropylamino)-propylphosphanium
CID 3090591
Bis-(dimethylamino)phenylphosphine
CID 327123
N,N-Dimethyl-P,P-diphenylphosphinic amide
CID 426131
n',n'-Dimethyl-p,p-diphenylphosphinous hydrazide
CID 272669
2-(Diphenylphosphanyl)-n,n-dimethylethanamine
CID 273266
Dimethylaminodiphenylphosphine
CID 11333675
Ph2PNEt2
CID 12140718
Dimethylamino-triphenylphosphine
CID 19035099
N'-diphenylphosphanyl-N,N,N'-trimethylethane-1,2-diamine
CID 86152590
1,3-Diphosphacyclobutadiene, 1,1,3,3-tetra(diethylamino)-2,4-diphenyl-
CID 145483
2-N,2-N',4-N,4-N'-tetramethyl-6,6-diphenyl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene-2,2,4,4-tetramine
CID 238027

Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine?
The IUPAC name of 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine (CID 134906744) is 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine.
What is the SMILES notation for 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine?
The canonical SMILES for 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine is CN(C)P1(N(C)C)=CP(N(C)C)(N(C)C)=C1P(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine?
The InChIKey is XWBHRZWPJNSFTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N4P3/c1-23(2)28(24(3)4)19-29(25(5)6,26(7)8)22(28)27(20-15-11-9-12-16-20)21-17-13-10-14-18-21/h9-19H,1-8H3.
What are the key properties of 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine?
2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine has a molecular weight of 448.47 g/mol, XLogP of 3.92, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphanyl-1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1λ5,3λ5-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine is sourced from PubChem (CID 134906744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).