5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide

C13H15NO3S2 — CID 30867028

IUPAC5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NCCOc2ccccc2)s1
InChIInChI=1S/C13H15NO3S2/c1-11-7-8-13(18-11)19(15,16)14-9-10-17-12-5-3-2-4-6-12/h2-8,14H,9-10H2,1H3
InChIKeyADBGTBZZTRFYBX-UHFFFAOYSA-N
MW297.40 g/mol
LogP2.41
Rot. Bonds6

About 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide

5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide (PubChem CID 30867028) has the molecular formula C13H15NO3S2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide
PubChem CID30867028
Molecular FormulaC13H15NO3S2
Molecular Weight297.40 g/mol
Exact Mass297.05
IUPAC Name5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NCCOc2ccccc2)s1
InChIInChI=1S/C13H15NO3S2/c1-11-7-8-13(18-11)19(15,16)14-9-10-17-12-5-3-2-4-6-12/h2-8,14H,9-10H2,1H3
InChIKeyADBGTBZZTRFYBX-UHFFFAOYSA-N
XLogP2.41
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-ethoxyphenoxy)ethyl]-5-methylthiophene-2-sulfonamide
CID 30366287
N-[2-(4-fluorophenoxy)ethyl]-5-methylthiophene-2-sulfonamide
CID 30867085
N-[2-(3,5-dimethylphenoxy)ethyl]-5-methylthiophene-2-sulfonamide
CID 30365965
5-bromo-N-(2-phenoxyethyl)thiophene-2-sulfonamide
CID 3488993
N-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]-5-methylthiophene-2-sulfonamide
CID 113101511
5-methyl-N-[2-(2,4,5-trimethylphenoxy)ethyl]thiophene-2-sulfonamide
CID 113101290
5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-(2-phenoxyethyl)thiophene-2-sulfonamide
CID 58808634
N-[2-(4-ethoxyphenoxy)ethyl]-5-ethylthiophene-2-sulfonamide
CID 30366253
N-[3-(2-bromoethoxy)propyl]-5-methylthiophene-2-sulfonamide
CID 106304861
N-(3-phenoxypropyl)thiophene-2-sulfonamide
CID 47122008
N-ethyl-5-methylthiophene-2-sulfonamide
CID 43212959
5-methyl-N-pentylthiophene-2-sulfonamide
CID 39791909

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide (CID 30867028) is 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)NCCOc2ccccc2)s1.
What is the InChIKey of 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide?
The InChIKey is ADBGTBZZTRFYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3S2/c1-11-7-8-13(18-11)19(15,16)14-9-10-17-12-5-3-2-4-6-12/h2-8,14H,9-10H2,1H3.
What are the key properties of 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide?
5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide has a molecular weight of 297.40 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-phenoxyethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 30867028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).