2-chloro-N,N-dimethylindole-1-sulfonamide

C10H11ClN2O2S — CID 143864173

IUPAC2-chloro-N,N-dimethylindole-1-sulfonamide
SMILESCN(C)S(=O)(=O)n1c(Cl)cc2ccccc21
InChIInChI=1S/C10H11ClN2O2S/c1-12(2)16(14,15)13-9-6-4-3-5-8(9)7-10(13)11/h3-7H,1-2H3
InChIKeyAFVBUFBPMZRPML-UHFFFAOYSA-N
MW258.73 g/mol
LogP1.95
Rot. Bonds2

About 2-chloro-N,N-dimethylindole-1-sulfonamide

2-chloro-N,N-dimethylindole-1-sulfonamide (PubChem CID 143864173) has the molecular formula C10H11ClN2O2S and a molecular weight of 258.73 g/mol. Its IUPAC name is 2-chloro-N,N-dimethylindole-1-sulfonamide.

Molecular Properties

Compound Name2-chloro-N,N-dimethylindole-1-sulfonamide
PubChem CID143864173
Molecular FormulaC10H11ClN2O2S
Molecular Weight258.73 g/mol
Exact Mass258.02
IUPAC Name2-chloro-N,N-dimethylindole-1-sulfonamide
SMILESCN(C)S(=O)(=O)n1c(Cl)cc2ccccc21
InChIInChI=1S/C10H11ClN2O2S/c1-12(2)16(14,15)13-9-6-4-3-5-8(9)7-10(13)11/h3-7H,1-2H3
InChIKeyAFVBUFBPMZRPML-UHFFFAOYSA-N
XLogP1.95
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.73
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(benzenesulfonyl)-2-chloroindole
CID 14416100
2-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-N,N-dimethylindole-1-sulfonamide
CID 100938517
4-chloro-2-cyano-N,N-dimethylbenzimidazole-1-sulfonamide
CID 13268093
2-[5-chloro-1-(dimethylsulfamoyl)benzimidazol-2-yl]quinoline-3-carboxylic acid
CID 67906740
6-chloro-2-cyano-N,N-dimethylbenzimidazole-1-sulfonamide
CID 13268091
CID 88588324
CID 88588324
2-(2-chlorophenyl)-1-(4-methylphenyl)sulfonylindole
CID 139694978
[1-(benzenesulfonyl)indol-2-yl]-trimethylstannane
CID 15421387
2-fluoro-1-(4-methylphenyl)sulfonylindole
CID 14921041
1-(benzenesulfonyl)-2-(chloromethyl)indole
CID 18925433
N,N-dimethyl-2-oxo-3,10,12-triaza-13-azoniapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),4,6,8,11,14,16,18,20-nonaene-10-sulfonamide
CID 16680962
6-chloro-N,N-dimethylbenzimidazole-1-sulfonamide
CID 86685792

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N,N-dimethylindole-1-sulfonamide?
The IUPAC name of 2-chloro-N,N-dimethylindole-1-sulfonamide (CID 143864173) is 2-chloro-N,N-dimethylindole-1-sulfonamide.
What is the SMILES notation for 2-chloro-N,N-dimethylindole-1-sulfonamide?
The canonical SMILES for 2-chloro-N,N-dimethylindole-1-sulfonamide is CN(C)S(=O)(=O)n1c(Cl)cc2ccccc21.
What is the InChIKey of 2-chloro-N,N-dimethylindole-1-sulfonamide?
The InChIKey is AFVBUFBPMZRPML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O2S/c1-12(2)16(14,15)13-9-6-4-3-5-8(9)7-10(13)11/h3-7H,1-2H3.
What are the key properties of 2-chloro-N,N-dimethylindole-1-sulfonamide?
2-chloro-N,N-dimethylindole-1-sulfonamide has a molecular weight of 258.73 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N,N-dimethylindole-1-sulfonamide is sourced from PubChem (CID 143864173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).