N,N-bis(diphenylphosphanyl)-4-ethenylaniline

C32H27NP2 — CID 130350038

IUPACN,N-bis(diphenylphosphanyl)-4-ethenylaniline
SMILESC=Cc1ccc(N(P(c2ccccc2)c2ccccc2)P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C32H27NP2/c1-2-27-23-25-28(26-24-27)33(34(29-15-7-3-8-16-29)30-17-9-4-10-18-30)35(31-19-11-5-12-20-31)32-21-13-6-14-22-32/h2-26H,1H2
InChIKeyZUZJOPWEPAVXSC-UHFFFAOYSA-N
MW487.52 g/mol
LogP7.23
Rot. Bonds8

About N,N-bis(diphenylphosphanyl)-4-ethenylaniline

N,N-bis(diphenylphosphanyl)-4-ethenylaniline (PubChem CID 130350038) has the molecular formula C32H27NP2 and a molecular weight of 487.52 g/mol. Its IUPAC name is N,N-bis(diphenylphosphanyl)-4-ethenylaniline.

Molecular Properties

Compound NameN,N-bis(diphenylphosphanyl)-4-ethenylaniline
PubChem CID130350038
Molecular FormulaC32H27NP2
Molecular Weight487.52 g/mol
Exact Mass487.16
IUPAC NameN,N-bis(diphenylphosphanyl)-4-ethenylaniline
SMILESC=Cc1ccc(N(P(c2ccccc2)c2ccccc2)P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C32H27NP2/c1-2-27-23-25-28(26-24-27)33(34(29-15-7-3-8-16-29)30-17-9-4-10-18-30)35(31-19-11-5-12-20-31)32-21-13-6-14-22-32/h2-26H,1H2
InChIKeyZUZJOPWEPAVXSC-UHFFFAOYSA-N
XLogP7.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.52
LogP ≤ 57.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-N,1-N,4-N,4-N-tetrakis(diphenylphosphanyl)benzene-1,4-diamine
CID 11423026
N-diphenylphosphanyl-4-ethenyl-N-methylaniline
CID 130416736
4-[4-[bis(diphenylphosphanyl)amino]phenoxy]-N,N-bis(diphenylphosphanyl)aniline
CID 118584651
bis((4-ethenylphenyl)-diphenylphosphane);rhodium(2+);dichloride
CID 139083534
4-[2-(4-ethenylphenyl)ethenyl]-N-[4-[2-(4-ethenylphenyl)ethenyl]phenyl]-N-phenylaniline
CID 142673851
1-(4-ethenylphenyl)-1,2-diphenylhydrazine
CID 150486079
4-ethenyl-N,N-diphenylaniline;4-ethenyl-N-phenyl-N-(4-phenylphenyl)aniline
CID 162186031
cadmium;styrene
CID 158944156
benzene;ethene;styrene
CID 159006852
CID 57450570
CID 57450570
styrene;tetrahydrofluoride
CID 68985344
4-ethenyl-N-phenylaniline
CID 21478062

Frequently Asked Questions

What is the IUPAC name of N,N-bis(diphenylphosphanyl)-4-ethenylaniline?
The IUPAC name of N,N-bis(diphenylphosphanyl)-4-ethenylaniline (CID 130350038) is N,N-bis(diphenylphosphanyl)-4-ethenylaniline.
What is the SMILES notation for N,N-bis(diphenylphosphanyl)-4-ethenylaniline?
The canonical SMILES for N,N-bis(diphenylphosphanyl)-4-ethenylaniline is C=Cc1ccc(N(P(c2ccccc2)c2ccccc2)P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N,N-bis(diphenylphosphanyl)-4-ethenylaniline?
The InChIKey is ZUZJOPWEPAVXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H27NP2/c1-2-27-23-25-28(26-24-27)33(34(29-15-7-3-8-16-29)30-17-9-4-10-18-30)35(31-19-11-5-12-20-31)32-21-13-6-14-22-32/h2-26H,1H2.
What are the key properties of N,N-bis(diphenylphosphanyl)-4-ethenylaniline?
N,N-bis(diphenylphosphanyl)-4-ethenylaniline has a molecular weight of 487.52 g/mol, XLogP of 7.23, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(diphenylphosphanyl)-4-ethenylaniline is sourced from PubChem (CID 130350038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).