1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione

C18H15NO3 — CID 10379624

IUPAC1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione
SMILESO=C1CC2(CO1)C(=O)N(Cc1ccccc1)c1ccccc12
InChIInChI=1S/C18H15NO3/c20-16-10-18(12-22-16)14-8-4-5-9-15(14)19(17(18)21)11-13-6-2-1-3-7-13/h1-9H,10-12H2
InChIKeyZKCYKPVRPQLFFZ-UHFFFAOYSA-N
MW293.32 g/mol
LogP2.42
Rot. Bonds2

About 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione

1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione (PubChem CID 10379624) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione.

Molecular Properties

Compound Name1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione
PubChem CID10379624
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione
SMILESO=C1CC2(CO1)C(=O)N(Cc1ccccc1)c1ccccc12
InChIInChI=1S/C18H15NO3/c20-16-10-18(12-22-16)14-8-4-5-9-15(14)19(17(18)21)11-13-6-2-1-3-7-13/h1-9H,10-12H2
InChIKeyZKCYKPVRPQLFFZ-UHFFFAOYSA-N
XLogP2.42
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione?
The IUPAC name of 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione (CID 10379624) is 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione.
What is the SMILES notation for 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione?
The canonical SMILES for 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione is O=C1CC2(CO1)C(=O)N(Cc1ccccc1)c1ccccc12.
What is the InChIKey of 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione?
The InChIKey is ZKCYKPVRPQLFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c20-16-10-18(12-22-16)14-8-4-5-9-15(14)19(17(18)21)11-13-6-2-1-3-7-13/h1-9H,10-12H2.
What are the key properties of 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione?
1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione has a molecular weight of 293.32 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzylspiro[indole-3,4'-oxolane]-2,2'-dione is sourced from PubChem (CID 10379624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).