1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide

C10H15N3O3 — CID 2877348

IUPAC1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C2CC(=O)NC2=O)CC1
InChIInChI=1S/C10H15N3O3/c11-9(15)6-1-3-13(4-2-6)7-5-8(14)12-10(7)16/h6-7H,1-5H2,(H2,11,15)(H,12,14,16)
InChIKeyKWZGBALFRUJOBU-UHFFFAOYSA-N
MW225.25 g/mol
LogP-1.40
Rot. Bonds2

About 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide

1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide (PubChem CID 2877348) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide
PubChem CID2877348
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C2CC(=O)NC2=O)CC1
InChIInChI=1S/C10H15N3O3/c11-9(15)6-1-3-13(4-2-6)7-5-8(14)12-10(7)16/h6-7H,1-5H2,(H2,11,15)(H,12,14,16)
InChIKeyKWZGBALFRUJOBU-UHFFFAOYSA-N
XLogP-1.40
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-1.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(4-Ethylpiperazin-1-yl)pyrrolidine-2,5-dione
CID 2989013
1-(1-Methyl-2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide
CID 2859665
1-(2,5-Dioxopyrrolidin-3-yl)-4-piperidin-1-ylpiperidine-4-carboxamide
CID 2936270
3-[4-(1-Piperidinylcarbonyl)-1-piperidinyl]-2,5-pyrrolidinedione
CID 2979075
(S)-4-((1S,5R)-2-aza-bicyclo[3.1.0]hexan-2-yl)-3-amino-4-oxobutanamide
CID 44433936
3-(4-Aminopiperidin-1-yl)pyrrolidine-2,5-dione dihydrochloride
CID 71756581
1-(Piperidine-4-carbonyl)pyrrolidine-2-carboxamide
CID 43212185
1-(1-Ethyl-2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide
CID 2936261
3-(3-Methylpyrrolidin-1-yl)piperidine-2,6-dione
CID 138467227
1-Methyl-3-(4-methylpiperidin-1-yl)pyrrolidine-2,5-dione
CID 3106524
3-(4-Methylpiperazin-1-yl)pyrrolidine-2,5-dione
CID 6458563
3-Piperidin-1-ylpyrrolidine-2,5-dione
CID 12550564

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide (CID 2877348) is 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide is NC(=O)C1CCN(C2CC(=O)NC2=O)CC1.
What is the InChIKey of 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide?
The InChIKey is KWZGBALFRUJOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c11-9(15)6-1-3-13(4-2-6)7-5-8(14)12-10(7)16/h6-7H,1-5H2,(H2,11,15)(H,12,14,16).
What are the key properties of 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide?
1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide has a molecular weight of 225.25 g/mol, XLogP of -1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dioxopyrrolidin-3-yl)piperidine-4-carboxamide is sourced from PubChem (CID 2877348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).