N-(2-phenylethyl)thiophene-2-sulfonamide

C12H13NO2S2 — CID 765827

IUPACN-(2-phenylethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1ccccc1)c1cccs1
InChIInChI=1S/C12H13NO2S2/c14-17(15,12-7-4-10-16-12)13-9-8-11-5-2-1-3-6-11/h1-7,10,13H,8-9H2
InChIKeyVDTQABLLNHGJNR-UHFFFAOYSA-N
MW267.38 g/mol
LogP2.27
Rot. Bonds5

About N-(2-phenylethyl)thiophene-2-sulfonamide

N-(2-phenylethyl)thiophene-2-sulfonamide (PubChem CID 765827) has the molecular formula C12H13NO2S2 and a molecular weight of 267.38 g/mol. Its IUPAC name is N-(2-phenylethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-phenylethyl)thiophene-2-sulfonamide
PubChem CID765827
Molecular FormulaC12H13NO2S2
Molecular Weight267.38 g/mol
Exact Mass267.04
IUPAC NameN-(2-phenylethyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1ccccc1)c1cccs1
InChIInChI=1S/C12H13NO2S2/c14-17(15,12-7-4-10-16-12)13-9-8-11-5-2-1-3-6-11/h1-7,10,13H,8-9H2
InChIKeyVDTQABLLNHGJNR-UHFFFAOYSA-N
XLogP2.27
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)thiophene-2-sulfonamide?
The IUPAC name of N-(2-phenylethyl)thiophene-2-sulfonamide (CID 765827) is N-(2-phenylethyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(2-phenylethyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(2-phenylethyl)thiophene-2-sulfonamide is O=S(=O)(NCCc1ccccc1)c1cccs1.
What is the InChIKey of N-(2-phenylethyl)thiophene-2-sulfonamide?
The InChIKey is VDTQABLLNHGJNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2S2/c14-17(15,12-7-4-10-16-12)13-9-8-11-5-2-1-3-6-11/h1-7,10,13H,8-9H2.
What are the key properties of N-(2-phenylethyl)thiophene-2-sulfonamide?
N-(2-phenylethyl)thiophene-2-sulfonamide has a molecular weight of 267.38 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 765827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).