(3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide

C14H19N3O3S — CID 95707296

IUPAC(3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12
InChIInChI=1S/C14H19N3O3S/c1-16(2)21(19,20)17-9-5-8-14(10-17)11-6-3-4-7-12(11)15-13(14)18/h3-4,6-7H,5,8-10H2,1-2H3,(H,15,18)/t14-/m0/s1
InChIKeyGUAQIWDPFHPKKW-AWEZNQCLSA-N
MW309.39 g/mol
LogP0.78
Rot. Bonds2

About (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide

(3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide (PubChem CID 95707296) has the molecular formula C14H19N3O3S and a molecular weight of 309.39 g/mol. Its IUPAC name is (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide.

Molecular Properties

Compound Name(3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide
PubChem CID95707296
Molecular FormulaC14H19N3O3S
Molecular Weight309.39 g/mol
Exact Mass309.11
IUPAC Name(3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12
InChIInChI=1S/C14H19N3O3S/c1-16(2)21(19,20)17-9-5-8-14(10-17)11-6-3-4-7-12(11)15-13(14)18/h3-4,6-7H,5,8-10H2,1-2H3,(H,15,18)/t14-/m0/s1
InChIKeyGUAQIWDPFHPKKW-AWEZNQCLSA-N
XLogP0.78
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.39
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1'-(1,3,5-trimethylpyrazol-4-yl)sulfonylspiro[1H-indole-3,3'-piperidine]-2-one
CID 56904006
(3S)-1'-(1,3,5-trimethylpyrazol-4-yl)sulfonylspiro[1H-indole-3,3'-piperidine]-2-one
CID 95717935
methyl-(2-oxospiro[1H-indole-3,3'-piperidine]-1'-yl)borinic acid
CID 59564965
1'-(2-methylpropyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 10199060
molecular hydrogen;spiro[1H-indole-3,1'-cyclobutane]-2-one
CID 145209538
(3R)-1'-(4-methylsulfonylbenzoyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 95716797
spiro[1H-indole-3,1'-cyclopropane]-2-one;hydrochloride
CID 141126988
N,N-dimethyl-2-oxospiro[1H-indole-3,4'-piperidine]-1'-carboxamide
CID 97449354
1'-propylspiro[1H-indole-3,3'-pyrrolidine]-2-one;hydrochloride
CID 3042074
spiro[1H-indole-3,3'-piperidine]-2-one;hydrochloride
CID 23500737
1'-ethylspiro[1H-indole-3,4'-piperidine]-2-one
CID 3042076
1'-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]spiro[1H-indole-3,3'-pyrrolidine]-2-one
CID 53176973

Frequently Asked Questions

What is the IUPAC name of (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide?
The IUPAC name of (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide (CID 95707296) is (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide.
What is the SMILES notation for (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide?
The canonical SMILES for (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide is CN(C)S(=O)(=O)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12.
What is the InChIKey of (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide?
The InChIKey is GUAQIWDPFHPKKW-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H19N3O3S/c1-16(2)21(19,20)17-9-5-8-14(10-17)11-6-3-4-7-12(11)15-13(14)18/h3-4,6-7H,5,8-10H2,1-2H3,(H,15,18)/t14-/m0/s1.
What are the key properties of (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide?
(3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide has a molecular weight of 309.39 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,N-dimethyl-2-oxospiro[1H-indole-3,3'-piperidine]-1'-sulfonamide is sourced from PubChem (CID 95707296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).