11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide

C22H32N2O3 — CID 17035156

IUPAC11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide
SMILESCN(C(=O)CCCCCCCCCCN1C(=O)CCC1=O)c1ccccc1
InChIInChI=1S/C22H32N2O3/c1-23(19-13-9-8-10-14-19)20(25)15-11-6-4-2-3-5-7-12-18-24-21(26)16-17-22(24)27/h8-10,13-14H,2-7,11-12,15-18H2,1H3
InChIKeyKUDFIFMUYBKIPB-UHFFFAOYSA-N
MW372.51 g/mol
LogP4.31
Rot. Bonds12

About 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide

11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide (PubChem CID 17035156) has the molecular formula C22H32N2O3 and a molecular weight of 372.51 g/mol. Its IUPAC name is 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide.

Molecular Properties

Compound Name11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide
PubChem CID17035156
Molecular FormulaC22H32N2O3
Molecular Weight372.51 g/mol
Exact Mass372.24
IUPAC Name11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide
SMILESCN(C(=O)CCCCCCCCCCN1C(=O)CCC1=O)c1ccccc1
InChIInChI=1S/C22H32N2O3/c1-23(19-13-9-8-10-14-19)20(25)15-11-6-4-2-3-5-7-12-18-24-21(26)16-17-22(24)27/h8-10,13-14H,2-7,11-12,15-18H2,1H3
InChIKeyKUDFIFMUYBKIPB-UHFFFAOYSA-N
XLogP4.31
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Succinanil
CID 66519
1-Phenylpyrrolidin-2-one
CID 78375
1-[4-(2-Oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
N-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-hydroxyheptanamide
CID 3719436
N,N'-diethyl-N,N'-diphenylhexanediamide
CID 1588111
4-(1-Azepanylcarbonyl)-1-phenyl-2-pyrrolidinone
CID 2978143
N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)-N-hydroxyhexanamide
CID 664797
Acetamide, N-[3-[[2-(2,5-dioxo-1-pyrrolidinyl)ethyl]ethylamino]phenyl]-
CID 119654
Dofamium Chloride
CID 72101
N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-phenylhexanamide
CID 660913
N,N'-diethyl-N,N'-diphenylpentanediamide
CID 1790967
Trimethyl-[4-(tetradecanoylamino)phenyl]azanium iodide
CID 71524043

Frequently Asked Questions

What is the IUPAC name of 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide?
The IUPAC name of 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide (CID 17035156) is 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide.
What is the SMILES notation for 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide?
The canonical SMILES for 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide is CN(C(=O)CCCCCCCCCCN1C(=O)CCC1=O)c1ccccc1.
What is the InChIKey of 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide?
The InChIKey is KUDFIFMUYBKIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O3/c1-23(19-13-9-8-10-14-19)20(25)15-11-6-4-2-3-5-7-12-18-24-21(26)16-17-22(24)27/h8-10,13-14H,2-7,11-12,15-18H2,1H3.
What are the key properties of 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide?
11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide has a molecular weight of 372.51 g/mol, XLogP of 4.31, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(2,5-dioxopyrrolidin-1-yl)-N-methyl-N-phenylundecanamide is sourced from PubChem (CID 17035156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).