1-(dimethylsulfamoyl)indole-6-carboxamide

C11H13N3O3S — CID 140520046

IUPAC1-(dimethylsulfamoyl)indole-6-carboxamide
SMILESCN(C)S(=O)(=O)n1ccc2ccc(C(N)=O)cc21
InChIInChI=1S/C11H13N3O3S/c1-13(2)18(16,17)14-6-5-8-3-4-9(11(12)15)7-10(8)14/h3-7H,1-2H3,(H2,12,15)
InChIKeyLGIVCVSWCGOJQZ-UHFFFAOYSA-N
MW267.31 g/mol
LogP0.39
Rot. Bonds3

About 1-(dimethylsulfamoyl)indole-6-carboxamide

1-(dimethylsulfamoyl)indole-6-carboxamide (PubChem CID 140520046) has the molecular formula C11H13N3O3S and a molecular weight of 267.31 g/mol. Its IUPAC name is 1-(dimethylsulfamoyl)indole-6-carboxamide.

Molecular Properties

Compound Name1-(dimethylsulfamoyl)indole-6-carboxamide
PubChem CID140520046
Molecular FormulaC11H13N3O3S
Molecular Weight267.31 g/mol
Exact Mass267.07
IUPAC Name1-(dimethylsulfamoyl)indole-6-carboxamide
SMILESCN(C)S(=O)(=O)n1ccc2ccc(C(N)=O)cc21
InChIInChI=1S/C11H13N3O3S/c1-13(2)18(16,17)14-6-5-8-3-4-9(11(12)15)7-10(8)14/h3-7H,1-2H3,(H2,12,15)
InChIKeyLGIVCVSWCGOJQZ-UHFFFAOYSA-N
XLogP0.39
TPSA85.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoyl)indole-6-carboxamide?
The IUPAC name of 1-(dimethylsulfamoyl)indole-6-carboxamide (CID 140520046) is 1-(dimethylsulfamoyl)indole-6-carboxamide.
What is the SMILES notation for 1-(dimethylsulfamoyl)indole-6-carboxamide?
The canonical SMILES for 1-(dimethylsulfamoyl)indole-6-carboxamide is CN(C)S(=O)(=O)n1ccc2ccc(C(N)=O)cc21.
What is the InChIKey of 1-(dimethylsulfamoyl)indole-6-carboxamide?
The InChIKey is LGIVCVSWCGOJQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3S/c1-13(2)18(16,17)14-6-5-8-3-4-9(11(12)15)7-10(8)14/h3-7H,1-2H3,(H2,12,15).
What are the key properties of 1-(dimethylsulfamoyl)indole-6-carboxamide?
1-(dimethylsulfamoyl)indole-6-carboxamide has a molecular weight of 267.31 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoyl)indole-6-carboxamide is sourced from PubChem (CID 140520046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).