1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one

C16H20N2O — CID 4267368

IUPAC—
SMILESCN1C(=O)C2(CCNC23CCCC3)c2ccccc21
InChIInChI=1S/C16H20N2O/c1-18-13-7-3-2-6-12(13)16(14(18)19)10-11-17-15(16)8-4-5-9-15/h2-3,6-7,17H,4-5,8-11H2,1H3
InChIKeyQXWBITMBUVPYMS-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.21
Rot. Bonds

About 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one

1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one (PubChem CID 4267368) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol.

Molecular Properties

Compound Name1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one
PubChem CID4267368
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name—
SMILESCN1C(=O)C2(CCNC23CCCC3)c2ccccc21
InChIInChI=1S/C16H20N2O/c1-18-13-7-3-2-6-12(13)16(14(18)19)10-11-17-15(16)8-4-5-9-15/h2-3,6-7,17H,4-5,8-11H2,1H3
InChIKeyQXWBITMBUVPYMS-UHFFFAOYSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one?
The IUPAC name of 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one (CID 4267368) is not available.
What is the SMILES notation for 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one?
The canonical SMILES for 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one is CN1C(=O)C2(CCNC23CCCC3)c2ccccc21.
What is the InChIKey of 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one?
The InChIKey is QXWBITMBUVPYMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-18-13-7-3-2-6-12(13)16(14(18)19)10-11-17-15(16)8-4-5-9-15/h2-3,6-7,17H,4-5,8-11H2,1H3.
What are the key properties of 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one?
1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one has a molecular weight of 256.35 g/mol, XLogP of 2.21, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1''-methyldispiro[cyclopentane-1,2'-pyrrolidine-3',3''-indol]-2''(1''H)-one is sourced from PubChem (CID 4267368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).