1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione

C15H23N3O3 — CID 62093415

IUPAC1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione
SMILESO=C1NCCCC1NC1CC(=O)N(C2CCCCC2)C1=O
InChIInChI=1S/C15H23N3O3/c19-13-9-12(17-11-7-4-8-16-14(11)20)15(21)18(13)10-5-2-1-3-6-10/h10-12,17H,1-9H2,(H,16,20)
InChIKeyHNLVPHRUUIIAOJ-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.31
Rot. Bonds3

About 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione

1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione (PubChem CID 62093415) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione
PubChem CID62093415
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione
SMILESO=C1NCCCC1NC1CC(=O)N(C2CCCCC2)C1=O
InChIInChI=1S/C15H23N3O3/c19-13-9-12(17-11-7-4-8-16-14(11)20)15(21)18(13)10-5-2-1-3-6-10/h10-12,17H,1-9H2,(H,16,20)
InChIKeyHNLVPHRUUIIAOJ-UHFFFAOYSA-N
XLogP0.31
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.31
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

1-cyclohexyl-3-[(1-methylpyrrolidin-3-yl)amino]pyrrolidine-2,5-dione
CID 61462553
1-cyclopropyl-3-(cyclopropylamino)pyrrolidine-2,5-dione
CID 43636099
1-cyclopentyl-3-[(2-methylcyclopentyl)amino]pyrrolidine-2,5-dione
CID 63277959
(3R)-3-[[(3S)-2-oxopiperidin-3-yl]amino]pyrrolidine-2,5-dione
CID 94349911
1-cyclohexyl-3-(cyclopropylmethylamino)pyrrolidine-2,5-dione
CID 43637329
1-cyclopentyl-3-[(2,3-dimethylcyclopentyl)amino]pyrrolidine-2,5-dione
CID 64907613
1-cyclohexyl-3-[(1-methylcyclopropyl)amino]pyrrolidine-2,5-dione
CID 113485379
1-cyclohexyl-3-(7-oxabicyclo[2.2.1]heptan-2-ylamino)pyrrolidine-2,5-dione
CID 80715430
1-cycloheptyl-3-(2,2-dimethylpropylamino)pyrrolidine-2,5-dione
CID 61166039
1-cyclopentyl-3-(pyridin-4-ylamino)pyrrolidine-2,5-dione
CID 43637410
3-anilino-1-cycloheptylpyrrolidine-2,5-dione
CID 43637260
(3R)-1-(4-ethoxyphenyl)-3-[[(3S)-2-oxopiperidin-3-yl]amino]pyrrolidine-2,5-dione
CID 755852

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione?
The IUPAC name of 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione (CID 62093415) is 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione?
The canonical SMILES for 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione is O=C1NCCCC1NC1CC(=O)N(C2CCCCC2)C1=O.
What is the InChIKey of 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione?
The InChIKey is HNLVPHRUUIIAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c19-13-9-12(17-11-7-4-8-16-14(11)20)15(21)18(13)10-5-2-1-3-6-10/h10-12,17H,1-9H2,(H,16,20).
What are the key properties of 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione?
1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione has a molecular weight of 293.37 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-[(2-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione is sourced from PubChem (CID 62093415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).