N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide

C14H13ClN2O2S2 — CID 113083889

IUPACN-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1c[nH]c2cc(Cl)ccc12)c1cccs1
InChIInChI=1S/C14H13ClN2O2S2/c15-11-3-4-12-10(9-16-13(12)8-11)5-6-17-21(18,19)14-2-1-7-20-14/h1-4,7-9,16-17H,5-6H2
InChIKeyWKJIMDSRZCXOPK-UHFFFAOYSA-N
MW340.86 g/mol
LogP3.40
Rot. Bonds5

About N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide

N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide (PubChem CID 113083889) has the molecular formula C14H13ClN2O2S2 and a molecular weight of 340.86 g/mol. Its IUPAC name is N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide
PubChem CID113083889
Molecular FormulaC14H13ClN2O2S2
Molecular Weight340.86 g/mol
Exact Mass340.01
IUPAC NameN-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1c[nH]c2cc(Cl)ccc12)c1cccs1
InChIInChI=1S/C14H13ClN2O2S2/c15-11-3-4-12-10(9-16-13(12)8-11)5-6-17-21(18,19)14-2-1-7-20-14/h1-4,7-9,16-17H,5-6H2
InChIKeyWKJIMDSRZCXOPK-UHFFFAOYSA-N
XLogP3.40
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.86
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(6-chloro-1H-indol-3-yl)ethyl]-5-ethylthiophene-2-sulfonamide
CID 113083891
N-[[1-(6-chloro-1H-indol-3-yl)cyclopropyl]methyl]thiophene-2-sulfonamide
CID 113085492
N-[2-(6-chloro-1H-indol-3-yl)ethyl]-4-ethylbenzenesulfonamide
CID 113083875
N-[2-(3-chlorophenyl)ethyl]thiophene-2-sulfonamide
CID 9301774
N-[2-(6-chloro-1H-indol-3-yl)ethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 113083900
N-[2-(5-chloro-1H-indol-3-yl)ethyl]benzenesulfonamide
CID 2991494
N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide
CID 110605316
N-[(6-chloro-1H-indol-3-yl)methyl]-2-thiophen-2-ylethanamine
CID 78968564
N-[2-(2,4-difluorophenyl)ethyl]thiophene-2-sulfonamide
CID 110789033
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-fluorobenzenesulfonamide
CID 3161292
N-[2-(3,4-dichlorophenyl)ethyl]thiophene-2-sulfonamide
CID 3810708
N-[2-(6-chloro-1H-indol-3-yl)ethyl]pyrimidin-2-amine
CID 133277622

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide (CID 113083889) is N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide is O=S(=O)(NCCc1c[nH]c2cc(Cl)ccc12)c1cccs1.
What is the InChIKey of N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide?
The InChIKey is WKJIMDSRZCXOPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2S2/c15-11-3-4-12-10(9-16-13(12)8-11)5-6-17-21(18,19)14-2-1-7-20-14/h1-4,7-9,16-17H,5-6H2.
What are the key properties of N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide?
N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide has a molecular weight of 340.86 g/mol, XLogP of 3.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 113083889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).