1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one

C16H20N2O3 — CID 134530668

IUPAC1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one
SMILESCOCN1C(=O)C2(CN(C(=O)C(C)C)C2)c2ccccc21
InChIInChI=1S/C16H20N2O3/c1-11(2)14(19)17-8-16(9-17)12-6-4-5-7-13(12)18(10-21-3)15(16)20/h4-7,11H,8-10H2,1-3H3
InChIKeySPEGJFPKNMMAID-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.37
Rot. Bonds3

About 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one

1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one (PubChem CID 134530668) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one.

Molecular Properties

Compound Name1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one
PubChem CID134530668
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one
SMILESCOCN1C(=O)C2(CN(C(=O)C(C)C)C2)c2ccccc21
InChIInChI=1S/C16H20N2O3/c1-11(2)14(19)17-8-16(9-17)12-6-4-5-7-13(12)18(10-21-3)15(16)20/h4-7,11H,8-10H2,1-3H3
InChIKeySPEGJFPKNMMAID-UHFFFAOYSA-N
XLogP1.37
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[5-chloro-2-[[1-(2-methylpropanoyl)-2'-oxospiro[azetidine-3,3'-indole]-1'-yl]methyl]indol-1-yl]butanenitrile
CID 144607605
methyl 2-oxo-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-1'-carboxylate
CID 134795039
(3R)-1'-[(1R,2R)-2-methylcyclopropanecarbonyl]-1-(2-methylpropyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 124825124
[1-(methoxymethyl)-2-oxo-3-(pentanoyloxymethyl)indol-3-yl]methyl pentanoate
CID 101139622
tert-butyl 3-[2-(2-bromophenyl)acetyl]azetidine-1-carboxylate;tert-butyl 3-[(2-bromophenyl)-[(4-methoxyphenyl)methyl]carbamoyl]azetidine-1-carboxylate;tert-butyl 1'-[(4-methoxyphenyl)methyl]-2'-oxospiro[azetidine-3,3'-indole]-1-carboxylate;1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one;1-(2-methylpropanoyl)-1'-(2-methylpropyl)spiro[azetidine-3,3'-indole]-2'-one;1'-(2-methylpropanoyl)spiro[1H-indole-3,3'-azetidine]-2-one;1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-3-carboxylic acid
CID 159565776
N-[2-[1-(2-methylpropyl)-2-oxospiro[indole-3,3'-pyrrolidine]-1'-yl]-2-oxoethyl]benzamide
CID 157015540
1-(2-cyclopentylbutanoyl)-1'-[2-(2-methylcyclohexen-1-yl)iminopropyl]spiro[azetidine-3,3'-indole]-2'-one
CID 144858676
1-(3-methoxypropyl)-1'-(1-methylimidazo[2,1-e]pyrazole-7-carbonyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 162638934
1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
CID 97375649
1-[(3-methoxyphenyl)methyl]-1'-(1H-pyrrole-2-carbonyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 157015900
1'-(2-hydroxy-4-methylpentanoyl)-1-methylspiro[indole-3,4'-piperidine]-2-one
CID 56919321
1-(3-methylbutyl)-1'-(1-methylimidazole-4-carbonyl)spiro[indole-3,3'-pyrrolidine]-2-one
CID 157018992

Frequently Asked Questions

What is the IUPAC name of 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one?
The IUPAC name of 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one (CID 134530668) is 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one.
What is the SMILES notation for 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one?
The canonical SMILES for 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one is COCN1C(=O)C2(CN(C(=O)C(C)C)C2)c2ccccc21.
What is the InChIKey of 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one?
The InChIKey is SPEGJFPKNMMAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-11(2)14(19)17-8-16(9-17)12-6-4-5-7-13(12)18(10-21-3)15(16)20/h4-7,11H,8-10H2,1-3H3.
What are the key properties of 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one?
1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one has a molecular weight of 288.35 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(methoxymethyl)-1-(2-methylpropanoyl)spiro[azetidine-3,3'-indole]-2'-one is sourced from PubChem (CID 134530668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).