7-methylspiro[1,2-dihydroindole-3,3'-oxolane]

C12H15NO — CID 106701925

IUPAC7-methylspiro[1,2-dihydroindole-3,3'-oxolane]
SMILESCc1cccc2c1NCC21CCOC1
InChIInChI=1S/C12H15NO/c1-9-3-2-4-10-11(9)13-7-12(10)5-6-14-8-12/h2-4,13H,5-8H2,1H3
InChIKeyGFYUXFQMHVDIFH-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.08
Rot. Bonds

About 7-methylspiro[1,2-dihydroindole-3,3'-oxolane]

7-methylspiro[1,2-dihydroindole-3,3'-oxolane] (PubChem CID 106701925) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 7-methylspiro[1,2-dihydroindole-3,3'-oxolane].

Molecular Properties

Compound Name7-methylspiro[1,2-dihydroindole-3,3'-oxolane]
PubChem CID106701925
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name7-methylspiro[1,2-dihydroindole-3,3'-oxolane]
SMILESCc1cccc2c1NCC21CCOC1
InChIInChI=1S/C12H15NO/c1-9-3-2-4-10-11(9)13-7-12(10)5-6-14-8-12/h2-4,13H,5-8H2,1H3
InChIKeyGFYUXFQMHVDIFH-UHFFFAOYSA-N
XLogP2.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methylspiro[1,2-dihydroindole-3,3'-oxolane]?
The IUPAC name of 7-methylspiro[1,2-dihydroindole-3,3'-oxolane] (CID 106701925) is 7-methylspiro[1,2-dihydroindole-3,3'-oxolane].
What is the SMILES notation for 7-methylspiro[1,2-dihydroindole-3,3'-oxolane]?
The canonical SMILES for 7-methylspiro[1,2-dihydroindole-3,3'-oxolane] is Cc1cccc2c1NCC21CCOC1.
What is the InChIKey of 7-methylspiro[1,2-dihydroindole-3,3'-oxolane]?
The InChIKey is GFYUXFQMHVDIFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-9-3-2-4-10-11(9)13-7-12(10)5-6-14-8-12/h2-4,13H,5-8H2,1H3.
What are the key properties of 7-methylspiro[1,2-dihydroindole-3,3'-oxolane]?
7-methylspiro[1,2-dihydroindole-3,3'-oxolane] has a molecular weight of 189.26 g/mol, XLogP of 2.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylspiro[1,2-dihydroindole-3,3'-oxolane] is sourced from PubChem (CID 106701925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).