N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine

C13H21N3O2S — CID 114807450

IUPACN-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine
SMILESCC(C)NS(=O)(=O)NCCC1CNc2ccccc21
InChIInChI=1S/C13H21N3O2S/c1-10(2)16-19(17,18)15-8-7-11-9-14-13-6-4-3-5-12(11)13/h3-6,10-11,14-16H,7-9H2,1-2H3
InChIKeySNTIEFZKCAHMEM-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.42
Rot. Bonds6

About N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine

N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine (PubChem CID 114807450) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine
PubChem CID114807450
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine
SMILESCC(C)NS(=O)(=O)NCCC1CNc2ccccc21
InChIInChI=1S/C13H21N3O2S/c1-10(2)16-19(17,18)15-8-7-11-9-14-13-6-4-3-5-12(11)13/h3-6,10-11,14-16H,7-9H2,1-2H3
InChIKeySNTIEFZKCAHMEM-UHFFFAOYSA-N
XLogP1.42
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine?
The IUPAC name of N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine (CID 114807450) is N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine.
What is the SMILES notation for N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine?
The canonical SMILES for N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine is CC(C)NS(=O)(=O)NCCC1CNc2ccccc21.
What is the InChIKey of N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine?
The InChIKey is SNTIEFZKCAHMEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-10(2)16-19(17,18)15-8-7-11-9-14-13-6-4-3-5-12(11)13/h3-6,10-11,14-16H,7-9H2,1-2H3.
What are the key properties of N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine?
N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine has a molecular weight of 283.40 g/mol, XLogP of 1.42, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-dihydro-1H-indol-3-yl)ethylsulfamoyl]propan-2-amine is sourced from PubChem (CID 114807450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).