silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate

C27H31AgNO3P — CID 56949989

IUPACsilver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate
SMILESCC(=O)[O-].CC(C)N(C(=O)c1ccccc1P(c1ccccc1)c1ccccc1)C(C)C.[Ag+]
InChIInChI=1S/C25H28NOP.C2H4O2.Ag/c1-19(2)26(20(3)4)25(27)23-17-11-12-18-24(23)28(21-13-7-5-8-14-21)22-15-9-6-10-16-22;1-2(3)4;/h5-20H,1-4H3;1H3,(H,3,4);/q;;+1/p-1
InChIKeyWOBRTLCSKLBAAW-UHFFFAOYSA-M
MW556.39 g/mol
LogP3.46
Rot. Bonds6

About silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate

silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate (PubChem CID 56949989) has the molecular formula C27H31AgNO3P and a molecular weight of 556.39 g/mol. Its IUPAC name is silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate.

Molecular Properties

Compound Namesilver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate
PubChem CID56949989
Molecular FormulaC27H31AgNO3P
Molecular Weight556.39 g/mol
Exact Mass555.11
IUPAC Namesilver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate
SMILESCC(=O)[O-].CC(C)N(C(=O)c1ccccc1P(c1ccccc1)c1ccccc1)C(C)C.[Ag+]
InChIInChI=1S/C25H28NOP.C2H4O2.Ag/c1-19(2)26(20(3)4)25(27)23-17-11-12-18-24(23)28(21-13-7-5-8-14-21)22-15-9-6-10-16-22;1-2(3)4;/h5-20H,1-4H3;1H3,(H,3,4);/q;;+1/p-1
InChIKeyWOBRTLCSKLBAAW-UHFFFAOYSA-M
XLogP3.46
TPSA60.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500556.39
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-diphenylphosphanylphenyl)-2-methylpropan-1-one
CID 146507667
1-(2-diphenylphosphanylphenyl)propane-1,2-dione;rhodium
CID 175984938
bis(di(propan-2-yl)carbamic acid);ruthenium;bis(triphenylphosphane)
CID 11480047
gold(3+);triphenylphosphane;triacetate
CID 160881940
palladium(2+);triphenylphosphane;diacetate
CID 11554889
copper(1+);tris(triphenylphosphane);acetate
CID 56954258
copper(1+);bis(triphenylphosphane);acetate
CID 175797724
bis(2-diphenylphosphanylbenzoic acid);palladium(2+);dichloride
CID 10190846
[2-(2-diphenylphosphanylbenzoyl)phenyl]-methyl-diphenylphosphanium
CID 88589569
2-diphenylphosphanyl-N-[(2S)-1-hydroxypropan-2-yl]benzamide
CID 149362786
1-(2-diphenylphosphanylphenyl)ethanimine
CID 139968166
[2-[di(propan-2-yl)carbamoyl]phenoxy]boronic acid
CID 142726714

Frequently Asked Questions

What is the IUPAC name of silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate?
The IUPAC name of silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate (CID 56949989) is silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate.
What is the SMILES notation for silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate?
The canonical SMILES for silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate is CC(=O)[O-].CC(C)N(C(=O)c1ccccc1P(c1ccccc1)c1ccccc1)C(C)C.[Ag+].
What is the InChIKey of silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate?
The InChIKey is WOBRTLCSKLBAAW-UHFFFAOYSA-M. The full InChI is InChI=1S/C25H28NOP.C2H4O2.Ag/c1-19(2)26(20(3)4)25(27)23-17-11-12-18-24(23)28(21-13-7-5-8-14-21)22-15-9-6-10-16-22;1-2(3)4;/h5-20H,1-4H3;1H3,(H,3,4);/q;;+1/p-1.
What are the key properties of silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate?
silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate has a molecular weight of 556.39 g/mol, XLogP of 3.46, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for silver;2-diphenylphosphanyl-N,N-di(propan-2-yl)benzamide;acetate is sourced from PubChem (CID 56949989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).