N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide

C10H14N2O2S — CID 2736127

IUPACN,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C10H14N2O2S/c1-12(2)15(13,14)9-3-4-10-8(7-9)5-6-11-10/h3-4,7,11H,5-6H2,1-2H3
InChIKeyRTBHIQIVIFMZDZ-UHFFFAOYSA-N
MW226.30 g/mol
LogP0.90
Rot. Bonds2

About N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide

N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 2736127) has the molecular formula C10H14N2O2S and a molecular weight of 226.30 g/mol. Its IUPAC name is N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID2736127
Molecular FormulaC10H14N2O2S
Molecular Weight226.30 g/mol
Exact Mass226.08
IUPAC NameN,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C10H14N2O2S/c1-12(2)15(13,14)9-3-4-10-8(7-9)5-6-11-10/h3-4,7,11H,5-6H2,1-2H3
InChIKeyRTBHIQIVIFMZDZ-UHFFFAOYSA-N
XLogP0.90
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide (CID 2736127) is N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide is CN(C)S(=O)(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is RTBHIQIVIFMZDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2S/c1-12(2)15(13,14)9-3-4-10-8(7-9)5-6-11-10/h3-4,7,11H,5-6H2,1-2H3.
What are the key properties of N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide?
N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 226.30 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 2736127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).