spiro[1H-indole-3,3'-oxolane]-2-one

C11H11NO2 — CID 58171286

IUPACspiro[1H-indole-3,3'-oxolane]-2-one
SMILESO=C1Nc2ccccc2C12CCOC2
InChIInChI=1S/C11H11NO2/c13-10-11(5-6-14-7-11)8-3-1-2-4-9(8)12-10/h1-4H,5-7H2,(H,12,13)
InChIKeyNNIUNZKAUJWBRU-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.30
Rot. Bonds

About spiro[1H-indole-3,3'-oxolane]-2-one

spiro[1H-indole-3,3'-oxolane]-2-one (PubChem CID 58171286) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is spiro[1H-indole-3,3'-oxolane]-2-one.

Molecular Properties

Compound Namespiro[1H-indole-3,3'-oxolane]-2-one
PubChem CID58171286
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Namespiro[1H-indole-3,3'-oxolane]-2-one
SMILESO=C1Nc2ccccc2C12CCOC2
InChIInChI=1S/C11H11NO2/c13-10-11(5-6-14-7-11)8-3-1-2-4-9(8)12-10/h1-4H,5-7H2,(H,12,13)
InChIKeyNNIUNZKAUJWBRU-UHFFFAOYSA-N
XLogP1.30
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[1H-indole-3,3'-oxolane]-2-one?
The IUPAC name of spiro[1H-indole-3,3'-oxolane]-2-one (CID 58171286) is spiro[1H-indole-3,3'-oxolane]-2-one.
What is the SMILES notation for spiro[1H-indole-3,3'-oxolane]-2-one?
The canonical SMILES for spiro[1H-indole-3,3'-oxolane]-2-one is O=C1Nc2ccccc2C12CCOC2.
What is the InChIKey of spiro[1H-indole-3,3'-oxolane]-2-one?
The InChIKey is NNIUNZKAUJWBRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c13-10-11(5-6-14-7-11)8-3-1-2-4-9(8)12-10/h1-4H,5-7H2,(H,12,13).
What are the key properties of spiro[1H-indole-3,3'-oxolane]-2-one?
spiro[1H-indole-3,3'-oxolane]-2-one has a molecular weight of 189.21 g/mol, XLogP of 1.30, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1H-indole-3,3'-oxolane]-2-one is sourced from PubChem (CID 58171286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).