N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide

C11H16N4O4 — CID 107436893

IUPACN-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide
SMILESCN1C(=O)CCC(NC(=O)C2CNC(=O)CN2)C1=O
InChIInChI=1S/C11H16N4O4/c1-15-9(17)3-2-6(11(15)19)14-10(18)7-4-13-8(16)5-12-7/h6-7,12H,2-5H2,1H3,(H,13,16)(H,14,18)
InChIKeyVPSMQIATCSQYBZ-UHFFFAOYSA-N
MW268.27 g/mol
LogP-2.66
Rot. Bonds2

About N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide

N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide (PubChem CID 107436893) has the molecular formula C11H16N4O4 and a molecular weight of 268.27 g/mol. Its IUPAC name is N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide
PubChem CID107436893
Molecular FormulaC11H16N4O4
Molecular Weight268.27 g/mol
Exact Mass268.12
IUPAC NameN-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide
SMILESCN1C(=O)CCC(NC(=O)C2CNC(=O)CN2)C1=O
InChIInChI=1S/C11H16N4O4/c1-15-9(17)3-2-6(11(15)19)14-10(18)7-4-13-8(16)5-12-7/h6-7,12H,2-5H2,1H3,(H,13,16)(H,14,18)
InChIKeyVPSMQIATCSQYBZ-UHFFFAOYSA-N
XLogP-2.66
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 5-2.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide 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-(1-methyl-2,6-dioxopiperidin-3-yl)thiomorpholine-3-carboxamide
CID 82915610
4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide
CID 114429205
2,2-difluoro-N-(1-methyl-2,6-dioxopiperidin-3-yl)acetamide
CID 103515786
N-(2-hydroxycyclohexyl)-5-oxopiperazine-2-carboxamide
CID 107436269
5-oxo-N-(1-oxothian-4-yl)piperazine-2-carboxamide
CID 107437601
1-tert-butyl-3-(1-methyl-2,6-dioxopiperidin-3-yl)urea
CID 116656521
4-amino-N-(1-methyl-2,6-dioxopiperidin-3-yl)oxolane-3-carboxamide
CID 66236911
trans-(1R,2R)-2-(4-fluorophenyl)-N-(1-methyl-2,6-dioxopiperidin-3-yl)cyclopropane-1-carboxamide
CID 146150011
N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-5-oxopiperazine-2-carboxamide
CID 107437497
(3S)-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 104896639
5-oxo-N-pentan-3-ylpiperazine-2-carboxamide
CID 107433338
2-[2-[(1-methyl-2,6-dioxopiperidin-3-yl)amino]-2-oxoethyl]sulfanylacetic acid
CID 113427800

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide?
The IUPAC name of N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide (CID 107436893) is N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide.
What is the SMILES notation for N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide?
The canonical SMILES for N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide is CN1C(=O)CCC(NC(=O)C2CNC(=O)CN2)C1=O.
What is the InChIKey of N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide?
The InChIKey is VPSMQIATCSQYBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O4/c1-15-9(17)3-2-6(11(15)19)14-10(18)7-4-13-8(16)5-12-7/h6-7,12H,2-5H2,1H3,(H,13,16)(H,14,18).
What are the key properties of N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide?
N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide has a molecular weight of 268.27 g/mol, XLogP of -2.66, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide is sourced from PubChem (CID 107436893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).