5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one

C14H16N2O5S — CID 46834728

IUPAC5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
SMILESO=C1Nc2ccc(S(=O)(=O)N3CCCC3)cc2C12OCCO2
InChIInChI=1S/C14H16N2O5S/c17-13-14(20-7-8-21-14)11-9-10(3-4-12(11)15-13)22(18,19)16-5-1-2-6-16/h3-4,9H,1-2,5-8H2,(H,15,17)
InChIKeyCWRDJERKXDCTPY-UHFFFAOYSA-N
MW324.36 g/mol
LogP0.62
Rot. Bonds2

About 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one

5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one (PubChem CID 46834728) has the molecular formula C14H16N2O5S and a molecular weight of 324.36 g/mol. Its IUPAC name is 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one.

Molecular Properties

Compound Name5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
PubChem CID46834728
Molecular FormulaC14H16N2O5S
Molecular Weight324.36 g/mol
Exact Mass324.08
IUPAC Name5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
SMILESO=C1Nc2ccc(S(=O)(=O)N3CCCC3)cc2C12OCCO2
InChIInChI=1S/C14H16N2O5S/c17-13-14(20-7-8-21-14)11-9-10(3-4-12(11)15-13)22(18,19)16-5-1-2-6-16/h3-4,9H,1-2,5-8H2,(H,15,17)
InChIKeyCWRDJERKXDCTPY-UHFFFAOYSA-N
XLogP0.62
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5'-(benzenesulfonyl)spiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
CID 67532672
2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide
CID 68654808
7-piperidin-1-ylsulfonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione
CID 20949437
N-benzyl-N-methyl-2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide
CID 58932585
1-[(3,3-dimethyl-2-oxo-1H-indol-5-yl)sulfonyl]piperidine-4-carboxamide
CID 110675383
7-piperidin-1-ylsulfonyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
CID 18422443
3-cyclopentylidene-5-piperidin-1-ylsulfonyl-1H-indol-2-one
CID 50760016
7-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione
CID 20949435
(2S)-7-(azepan-1-ylsulfonyl)-2-methyl-4H-1,4-benzoxazin-3-one
CID 124854790
4-methyl-6-pyrrolidin-1-ylsulfonyl-1,3-dihydroquinoxalin-2-one
CID 156743603
6-(azepan-1-ylsulfonyl)-4H-1,4-benzoxazin-3-one
CID 22548236
1'-(3-hydroxy-3-methylbutyl)-5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxane-2,3'-indole]-2'-one
CID 91047024

Frequently Asked Questions

What is the IUPAC name of 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
The IUPAC name of 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one (CID 46834728) is 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one.
What is the SMILES notation for 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
The canonical SMILES for 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one is O=C1Nc2ccc(S(=O)(=O)N3CCCC3)cc2C12OCCO2.
What is the InChIKey of 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
The InChIKey is CWRDJERKXDCTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O5S/c17-13-14(20-7-8-21-14)11-9-10(3-4-12(11)15-13)22(18,19)16-5-1-2-6-16/h3-4,9H,1-2,5-8H2,(H,15,17).
What are the key properties of 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one has a molecular weight of 324.36 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-pyrrolidin-1-ylsulfonylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one is sourced from PubChem (CID 46834728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).