spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione

C14H15NO2 — CID 12790938

IUPACspiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione
SMILESO=C1CCC2(CCCc3ccccc32)C(=O)N1
InChIInChI=1S/C14H15NO2/c16-12-7-9-14(13(17)15-12)8-3-5-10-4-1-2-6-11(10)14/h1-2,4,6H,3,5,7-9H2,(H,15,16,17)
InChIKeyGBWHKJMTBAATQB-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.70
Rot. Bonds

About spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione

spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione (PubChem CID 12790938) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione.

Molecular Properties

Compound Namespiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione
PubChem CID12790938
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Namespiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione
SMILESO=C1CCC2(CCCc3ccccc32)C(=O)N1
InChIInChI=1S/C14H15NO2/c16-12-7-9-14(13(17)15-12)8-3-5-10-4-1-2-6-11(10)14/h1-2,4,6H,3,5,7-9H2,(H,15,16,17)
InChIKeyGBWHKJMTBAATQB-UHFFFAOYSA-N
XLogP1.70
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione?
The IUPAC name of spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione (CID 12790938) is spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione.
What is the SMILES notation for spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione?
The canonical SMILES for spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione is O=C1CCC2(CCCc3ccccc32)C(=O)N1.
What is the InChIKey of spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione?
The InChIKey is GBWHKJMTBAATQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c16-12-7-9-14(13(17)15-12)8-3-5-10-4-1-2-6-11(10)14/h1-2,4,6H,3,5,7-9H2,(H,15,16,17).
What are the key properties of spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione?
spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione has a molecular weight of 229.28 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-2',6'-dione is sourced from PubChem (CID 12790938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).