1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione

C14H15NO2 — CID 11658668

IUPAC1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione
SMILESCN1C(=O)C2(CCC(=O)CC2)c2ccccc21
InChIInChI=1S/C14H15NO2/c1-15-12-5-3-2-4-11(12)14(13(15)17)8-6-10(16)7-9-14/h2-5H,6-9H2,1H3
InChIKeyUENSDENWNDIVAT-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.04
Rot. Bonds

About 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione

1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione (PubChem CID 11658668) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione.

Molecular Properties

Compound Name1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione
PubChem CID11658668
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione
SMILESCN1C(=O)C2(CCC(=O)CC2)c2ccccc21
InChIInChI=1S/C14H15NO2/c1-15-12-5-3-2-4-11(12)14(13(15)17)8-6-10(16)7-9-14/h2-5H,6-9H2,1H3
InChIKeyUENSDENWNDIVAT-UHFFFAOYSA-N
XLogP2.04
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione?
The IUPAC name of 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione (CID 11658668) is 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione.
What is the SMILES notation for 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione?
The canonical SMILES for 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione is CN1C(=O)C2(CCC(=O)CC2)c2ccccc21.
What is the InChIKey of 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione?
The InChIKey is UENSDENWNDIVAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-15-12-5-3-2-4-11(12)14(13(15)17)8-6-10(16)7-9-14/h2-5H,6-9H2,1H3.
What are the key properties of 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione?
1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione has a molecular weight of 229.28 g/mol, XLogP of 2.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methylspiro[cyclohexane-4,3'-indole]-1,2'-dione is sourced from PubChem (CID 11658668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).