1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one

C18H24N2O2 — CID 95724009

IUPAC1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one
SMILESCN1C(=O)C2(CCN(C[C@H]3CCCO3)CC2)c2ccccc21
InChIInChI=1S/C18H24N2O2/c1-19-16-7-3-2-6-15(16)18(17(19)21)8-10-20(11-9-18)13-14-5-4-12-22-14/h2-3,6-7,14H,4-5,8-13H2,1H3/t14-/m1/s1
InChIKeyOOPPXSFLXWOISH-CQSZACIVSA-N
MW300.40 g/mol
LogP2.18
Rot. Bonds2

About 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one

1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one (PubChem CID 95724009) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one.

Molecular Properties

Compound Name1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one
PubChem CID95724009
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one
SMILESCN1C(=O)C2(CCN(C[C@H]3CCCO3)CC2)c2ccccc21
InChIInChI=1S/C18H24N2O2/c1-19-16-7-3-2-6-15(16)18(17(19)21)8-10-20(11-9-18)13-14-5-4-12-22-14/h2-3,6-7,14H,4-5,8-13H2,1H3/t14-/m1/s1
InChIKeyOOPPXSFLXWOISH-CQSZACIVSA-N
XLogP2.18
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one?
The IUPAC name of 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one (CID 95724009) is 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one.
What is the SMILES notation for 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one?
The canonical SMILES for 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one is CN1C(=O)C2(CCN(C[C@H]3CCCO3)CC2)c2ccccc21.
What is the InChIKey of 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one?
The InChIKey is OOPPXSFLXWOISH-CQSZACIVSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-19-16-7-3-2-6-15(16)18(17(19)21)8-10-20(11-9-18)13-14-5-4-12-22-14/h2-3,6-7,14H,4-5,8-13H2,1H3/t14-/m1/s1.
What are the key properties of 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one?
1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one has a molecular weight of 300.40 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1'-[[(2R)-oxolan-2-yl]methyl]spiro[indole-3,4'-piperidine]-2-one is sourced from PubChem (CID 95724009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).