N-(2-aminoethyl)-1H-indole-3-sulfonamide

C10H13N3O2S — CID 82292478

IUPACN-(2-aminoethyl)-1H-indole-3-sulfonamide
SMILESNCCNS(=O)(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C10H13N3O2S/c11-5-6-13-16(14,15)10-7-12-9-4-2-1-3-8(9)10/h1-4,7,12-13H,5-6,11H2
InChIKeyIEUBIRCMBVEZNF-UHFFFAOYSA-N
MW239.30 g/mol
LogP0.40
Rot. Bonds4

About N-(2-aminoethyl)-1H-indole-3-sulfonamide

N-(2-aminoethyl)-1H-indole-3-sulfonamide (PubChem CID 82292478) has the molecular formula C10H13N3O2S and a molecular weight of 239.30 g/mol. Its IUPAC name is N-(2-aminoethyl)-1H-indole-3-sulfonamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-1H-indole-3-sulfonamide
PubChem CID82292478
Molecular FormulaC10H13N3O2S
Molecular Weight239.30 g/mol
Exact Mass239.07
IUPAC NameN-(2-aminoethyl)-1H-indole-3-sulfonamide
SMILESNCCNS(=O)(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C10H13N3O2S/c11-5-6-13-16(14,15)10-7-12-9-4-2-1-3-8(9)10/h1-4,7,12-13H,5-6,11H2
InChIKeyIEUBIRCMBVEZNF-UHFFFAOYSA-N
XLogP0.40
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.30
LogP ≤ 50.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1H-indole-3-sulfonohydrazide
CID 82284140
N-chloro-1H-indole-3-sulfonamide
CID 90719858
N'-[2-(1H-indol-3-yl)ethylsulfamoyl]ethane-1,2-diamine
CID 84760927
3-methylsulfonyl-1H-indole
CID 86767790
N-[2-(1H-indol-3-yl)ethyl]-2,4,5-trimethylbenzenesulfonamide
CID 35539650
5-amino-N-(3-hydroxypropyl)-1H-indole-3-sulfonamide
CID 64853230
2,6-difluoro-N-[2-(1H-indol-3-yl)ethyl]benzenesulfonamide
CID 25035880
N-(2-aminoethyl)-2-tert-butylbenzenesulfonamide
CID 86814125
2-(1H-indol-3-ylsulfonylamino)propanoic acid
CID 82487562
2-acetamido-N-(1H-indol-3-ylsulfonyl)-4-methylpentanamide
CID 167936324
tert-butyl N-(1H-indol-3-ylsulfonyl)carbamate
CID 86620846
N-(2-aminoethyl)-2-chloro-5-(6-fluoro-1H-indol-3-yl)benzenesulfonamide
CID 126574745

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1H-indole-3-sulfonamide?
The IUPAC name of N-(2-aminoethyl)-1H-indole-3-sulfonamide (CID 82292478) is N-(2-aminoethyl)-1H-indole-3-sulfonamide.
What is the SMILES notation for N-(2-aminoethyl)-1H-indole-3-sulfonamide?
The canonical SMILES for N-(2-aminoethyl)-1H-indole-3-sulfonamide is NCCNS(=O)(=O)c1c[nH]c2ccccc12.
What is the InChIKey of N-(2-aminoethyl)-1H-indole-3-sulfonamide?
The InChIKey is IEUBIRCMBVEZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2S/c11-5-6-13-16(14,15)10-7-12-9-4-2-1-3-8(9)10/h1-4,7,12-13H,5-6,11H2.
What are the key properties of N-(2-aminoethyl)-1H-indole-3-sulfonamide?
N-(2-aminoethyl)-1H-indole-3-sulfonamide has a molecular weight of 239.30 g/mol, XLogP of 0.40, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1H-indole-3-sulfonamide is sourced from PubChem (CID 82292478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).