N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide

C15H16N2O2S2 — CID 3777897

IUPACN-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide
SMILESCC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cccs1
InChIInChI=1S/C15H16N2O2S2/c1-11(17-21(18,19)15-7-4-8-20-15)9-12-10-16-14-6-3-2-5-13(12)14/h2-8,10-11,16-17H,9H2,1H3
InChIKeyGETTYXXMBPWCTF-UHFFFAOYSA-N
MW320.44 g/mol
LogP3.14
Rot. Bonds5

About N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide

N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide (PubChem CID 3777897) has the molecular formula C15H16N2O2S2 and a molecular weight of 320.44 g/mol. Its IUPAC name is N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide
PubChem CID3777897
Molecular FormulaC15H16N2O2S2
Molecular Weight320.44 g/mol
Exact Mass320.07
IUPAC NameN-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide
SMILESCC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cccs1
InChIInChI=1S/C15H16N2O2S2/c1-11(17-21(18,19)15-7-4-8-20-15)9-12-10-16-14-6-3-2-5-13(12)14/h2-8,10-11,16-17H,9H2,1H3
InChIKeyGETTYXXMBPWCTF-UHFFFAOYSA-N
XLogP3.14
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[1-(1H-indol-3-yl)propan-2-yl]benzenesulfonamide
CID 25047405
4-cyano-N-[1-(1H-indol-3-yl)propan-2-yl]benzenesulfonamide
CID 3790571
N-[1-(1H-indol-3-yl)propan-2-yl]-2,5-dimethoxybenzenesulfonamide
CID 3833416
N-[1-(1H-indol-3-yl)propan-2-yl]-2-(trifluoromethoxy)benzenesulfonamide
CID 3587295
N-[1-(1H-indol-3-yl)propan-2-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide
CID 10249451
2,5-dibromo-3,6-dichloro-N-[1-(1H-indol-3-yl)propan-2-yl]benzenesulfonamide
CID 10325022
N-(1-methoxypropan-2-yl)thiophene-2-sulfonamide
CID 3781964
N-[2-chloro-4-[1-(1H-indol-3-yl)propan-2-ylsulfamoyl]phenyl]acetamide
CID 3759368
N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[4-(thiophen-2-ylsulfonylamino)piperidin-1-yl]propan-2-yl]acetamide
CID 33172344
N-[1-(1H-indol-3-yl)propan-2-yl]butanamide
CID 5022905
N-(4-phenylbutan-2-yl)thiophene-2-sulfonamide
CID 3722193
N-[1-(1H-indol-3-yl)propan-2-yl]pyridine-4-carboxamide
CID 3677874

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide?
The IUPAC name of N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide (CID 3777897) is N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide?
The canonical SMILES for N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide is CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cccs1.
What is the InChIKey of N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide?
The InChIKey is GETTYXXMBPWCTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S2/c1-11(17-21(18,19)15-7-4-8-20-15)9-12-10-16-14-6-3-2-5-13(12)14/h2-8,10-11,16-17H,9H2,1H3.
What are the key properties of N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide?
N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide has a molecular weight of 320.44 g/mol, XLogP of 3.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-indol-3-yl)propan-2-yl]thiophene-2-sulfonamide is sourced from PubChem (CID 3777897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).