3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione

C16H27N3O2 — CID 79540257

IUPAC3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione
SMILESO=C1CCC(NC2CCCCC2C2CCCCN2)C(=O)N1
InChIInChI=1S/C16H27N3O2/c20-15-9-8-14(16(21)19-15)18-13-7-2-1-5-11(13)12-6-3-4-10-17-12/h11-14,17-18H,1-10H2,(H,19,20,21)
InChIKeyOQWCLKMAABUCFY-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.08
Rot. Bonds3

About 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione

3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione (PubChem CID 79540257) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione
PubChem CID79540257
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione
SMILESO=C1CCC(NC2CCCCC2C2CCCCN2)C(=O)N1
InChIInChI=1S/C16H27N3O2/c20-15-9-8-14(16(21)19-15)18-13-7-2-1-5-11(13)12-6-3-4-10-17-12/h11-14,17-18H,1-10H2,(H,19,20,21)
InChIKeyOQWCLKMAABUCFY-UHFFFAOYSA-N
XLogP1.08
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione?
The IUPAC name of 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione (CID 79540257) is 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione.
What is the SMILES notation for 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione?
The canonical SMILES for 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione is O=C1CCC(NC2CCCCC2C2CCCCN2)C(=O)N1.
What is the InChIKey of 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione?
The InChIKey is OQWCLKMAABUCFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c20-15-9-8-14(16(21)19-15)18-13-7-2-1-5-11(13)12-6-3-4-10-17-12/h11-14,17-18H,1-10H2,(H,19,20,21).
What are the key properties of 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione?
3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione has a molecular weight of 293.41 g/mol, XLogP of 1.08, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-piperidin-2-ylcyclohexyl)amino]piperidine-2,6-dione is sourced from PubChem (CID 79540257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).