1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione

C20H22N2O2Si — CID 123653410

IUPAC1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione
SMILESCN(CCCN1C(=O)C=CC1=O)[SiH](c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O2Si/c1-21(15-8-16-22-19(23)13-14-20(22)24)25(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-7,9-14,25H,8,15-16H2,1H3
InChIKeySVVQPGNUTYXDCE-UHFFFAOYSA-N
MW350.49 g/mol
LogP0.77
Rot. Bonds7

About 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione

1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione (PubChem CID 123653410) has the molecular formula C20H22N2O2Si and a molecular weight of 350.49 g/mol. Its IUPAC name is 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione.

Molecular Properties

Compound Name1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione
PubChem CID123653410
Molecular FormulaC20H22N2O2Si
Molecular Weight350.49 g/mol
Exact Mass350.15
IUPAC Name1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione
SMILESCN(CCCN1C(=O)C=CC1=O)[SiH](c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O2Si/c1-21(15-8-16-22-19(23)13-14-20(22)24)25(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-7,9-14,25H,8,15-16H2,1H3
InChIKeySVVQPGNUTYXDCE-UHFFFAOYSA-N
XLogP0.77
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.49
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-Ethyl-3,4-bis(phenylselanyl)pyrrole-2,5-dione
CID 178319292
1-[[Ethenyl(diphenyl)silyl]oxymethyl]pyrrole-2,5-dione
CID 20591160
1-[3-(2,2-Diphenylazasilolidin-1-yl)propyl]pyrrole-2,5-dione
CID 67079750
1-[3-(2,2-Diphenylazasilinan-1-yl)propyl]pyrrole-2,5-dione
CID 67080032
1-[3-[Bis(triphenylsilyl)amino]propyl]pyrrole-2,5-dione
CID 87260783
1-(3-Amino-4-triphenylsilylbutyl)pyrrole-2,5-dione
CID 87260898
1-[3-[Methyl(triphenylsilyl)amino]propyl]pyrrole-2,5-dione
CID 87317172
1-[3-(Methylamino)-3-triphenylsilylpropyl]pyrrole-2,5-dione
CID 87317173
N-[2-[hydroxy(diphenyl)silyl]-2-methylpropyl]-N-methylprop-2-enamide
CID 89346412
1-(3-Amino-4-diphenylsilylbutyl)pyrrole-2,5-dione
CID 123515113
1-[3-[Bis(diphenylsilyl)amino]propyl]pyrrole-2,5-dione
CID 123931570
1-Triphenylsilylpyrrole-2,5-dione
CID 139730516

Frequently Asked Questions

What is the IUPAC name of 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione?
The IUPAC name of 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione (CID 123653410) is 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione.
What is the SMILES notation for 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione?
The canonical SMILES for 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione is CN(CCCN1C(=O)C=CC1=O)[SiH](c1ccccc1)c1ccccc1.
What is the InChIKey of 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione?
The InChIKey is SVVQPGNUTYXDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2Si/c1-21(15-8-16-22-19(23)13-14-20(22)24)25(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-7,9-14,25H,8,15-16H2,1H3.
What are the key properties of 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione?
1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione has a molecular weight of 350.49 g/mol, XLogP of 0.77, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[diphenylsilyl(methyl)amino]propyl]pyrrole-2,5-dione is sourced from PubChem (CID 123653410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).