(3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one

C16H20N2O3 — CID 95718964

IUPAC(3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one
SMILESCCOCC(=O)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12
InChIInChI=1S/C16H20N2O3/c1-2-21-10-14(19)18-9-5-8-16(11-18)12-6-3-4-7-13(12)17-15(16)20/h3-4,6-7H,2,5,8-11H2,1H3,(H,17,20)/t16-/m0/s1
InChIKeyJFMAIEGTWDDITQ-INIZCTEOSA-N
MW288.35 g/mol
LogP1.54
Rot. Bonds3

About (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one

(3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one (PubChem CID 95718964) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one.

Molecular Properties

Compound Name(3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one
PubChem CID95718964
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name(3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one
SMILESCCOCC(=O)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12
InChIInChI=1S/C16H20N2O3/c1-2-21-10-14(19)18-9-5-8-16(11-18)12-6-3-4-7-13(12)17-15(16)20/h3-4,6-7H,2,5,8-11H2,1H3,(H,17,20)/t16-/m0/s1
InChIKeyJFMAIEGTWDDITQ-INIZCTEOSA-N
XLogP1.54
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1'-(2-ethoxybenzoyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 95718493
(3R)-1'-(2-ethoxybenzoyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 95718494
1'-[2-(1,3-benzodioxol-5-yl)acetyl]spiro[1H-indole-3,3'-piperidine]-2-one
CID 56917233
(3S)-N-(2-methoxyphenyl)-2-oxospiro[1H-indole-3,3'-piperidine]-1'-carboxamide
CID 95722580
(3R)-1'-(4-methylsulfonylbenzoyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 95716797
(3S)-N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-2-oxospiro[1H-indole-3,3'-piperidine]-1'-carboxamide
CID 126435597
1'-(2-imidazo[1,2-a]pyridin-3-ylacetyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 56911511
2-oxospiro[1H-indole-3,3'-pyrrolidine]-1'-carboxamide
CID 154879377
(3R)-1'-(2-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 95712790
4'-(4-butanoyl-1,4-diazepan-1-yl)spiro[1H-indole-3,1'-cyclohexane]-2-one
CID 134431872
2-oxo-N-propylspiro[1H-indole-3,3'-pyrrolidine]-1'-carboxamide
CID 53177006
(3S)-2-oxo-N-propylspiro[1H-indole-3,3'-pyrrolidine]-1'-carboxamide
CID 129369255

Frequently Asked Questions

What is the IUPAC name of (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one?
The IUPAC name of (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one (CID 95718964) is (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one.
What is the SMILES notation for (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one?
The canonical SMILES for (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one is CCOCC(=O)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12.
What is the InChIKey of (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one?
The InChIKey is JFMAIEGTWDDITQ-INIZCTEOSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-2-21-10-14(19)18-9-5-8-16(11-18)12-6-3-4-7-13(12)17-15(16)20/h3-4,6-7H,2,5,8-11H2,1H3,(H,17,20)/t16-/m0/s1.
What are the key properties of (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one?
(3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one has a molecular weight of 288.35 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1'-(2-ethoxyacetyl)spiro[1H-indole-3,3'-piperidine]-2-one is sourced from PubChem (CID 95718964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).