N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide

C28H37N3O3 — CID 54542729

IUPACN-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide
SMILESO=C(NCCCCCCCCCCC(=O)N1C(=O)NCC1Cc1ccccc1)c1ccccc1
InChIInChI=1S/C28H37N3O3/c32-26(31-25(22-30-28(31)34)21-23-15-9-7-10-16-23)19-13-5-3-1-2-4-6-14-20-29-27(33)24-17-11-8-12-18-24/h7-12,15-18,25H,1-6,13-14,19-22H2,(H,29,33)(H,30,34)
InChIKeyZEJYSMYETUGUQJ-UHFFFAOYSA-N
MW463.62 g/mol
LogP5.09
Rot. Bonds14

About N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide

N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide (PubChem CID 54542729) has the molecular formula C28H37N3O3 and a molecular weight of 463.62 g/mol. Its IUPAC name is N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide.

Molecular Properties

Compound NameN-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide
PubChem CID54542729
Molecular FormulaC28H37N3O3
Molecular Weight463.62 g/mol
Exact Mass463.28
IUPAC NameN-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide
SMILESO=C(NCCCCCCCCCCC(=O)N1C(=O)NCC1Cc1ccccc1)c1ccccc1
InChIInChI=1S/C28H37N3O3/c32-26(31-25(22-30-28(31)34)21-23-15-9-7-10-16-23)19-13-5-3-1-2-4-6-14-20-29-27(33)24-17-11-8-12-18-24/h7-12,15-18,25H,1-6,13-14,19-22H2,(H,29,33)(H,30,34)
InChIKeyZEJYSMYETUGUQJ-UHFFFAOYSA-N
XLogP5.09
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.62
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-hydrazinyl-6-oxohexyl)benzamide
CID 5226635
1,6-bis[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]hexane-1,6-dione
CID 92642348
N-[6-(3,5-dimethylpyrazol-1-yl)-6-oxohexyl]benzamide
CID 6486736
N-[4-oxo-4-[4-(2-phenylethyl)piperazin-1-yl]butyl]benzamide
CID 31952128
benzyl 6-benzamido-2-oxohexanoate
CID 134392614
trimethylsilyl 10-benzamidodecanoate
CID 10808726
(4R)-4-benzyl-3-(6-phenylhexanoyl)-1,3-oxazolidin-2-one
CID 70251380
(2,5-dioxopyrrolidin-1-yl) 6-[(4-benzoylbenzoyl)amino]hexanoate
CID 18671258
N-[6-(5-hydroxypentylamino)-6-oxohexyl]benzamide
CID 110839273
N-(4-oxopentyl)benzamide
CID 10798281
N-[6-(2-methoxyethylamino)-6-oxohexyl]benzamide
CID 110839208
3-(2-phenylethoxy)-N-[8-[[3-(2-phenylethoxy)benzoyl]amino]octyl]benzamide
CID 17233441

Frequently Asked Questions

What is the IUPAC name of N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide?
The IUPAC name of N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide (CID 54542729) is N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide.
What is the SMILES notation for N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide?
The canonical SMILES for N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide is O=C(NCCCCCCCCCCC(=O)N1C(=O)NCC1Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide?
The InChIKey is ZEJYSMYETUGUQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H37N3O3/c32-26(31-25(22-30-28(31)34)21-23-15-9-7-10-16-23)19-13-5-3-1-2-4-6-14-20-29-27(33)24-17-11-8-12-18-24/h7-12,15-18,25H,1-6,13-14,19-22H2,(H,29,33)(H,30,34).
What are the key properties of N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide?
N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide has a molecular weight of 463.62 g/mol, XLogP of 5.09, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[11-(5-benzyl-2-oxoimidazolidin-1-yl)-11-oxoundecyl]benzamide is sourced from PubChem (CID 54542729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).