5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide

C11H19NO3S2 — CID 110602852

IUPAC5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCCOC(C)C)s1
InChIInChI=1S/C11H19NO3S2/c1-4-10-5-6-11(16-10)17(13,14)12-7-8-15-9(2)3/h5-6,9,12H,4,7-8H2,1-3H3
InChIKeyVDSZFVQVROZHJZ-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.01
Rot. Bonds7

About 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide

5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide (PubChem CID 110602852) has the molecular formula C11H19NO3S2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide
PubChem CID110602852
Molecular FormulaC11H19NO3S2
Molecular Weight277.41 g/mol
Exact Mass277.08
IUPAC Name5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCCOC(C)C)s1
InChIInChI=1S/C11H19NO3S2/c1-4-10-5-6-11(16-10)17(13,14)12-7-8-15-9(2)3/h5-6,9,12H,4,7-8H2,1-3H3
InChIKeyVDSZFVQVROZHJZ-UHFFFAOYSA-N
XLogP2.01
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.01
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-ethylthiophene-2-sulfonamide
CID 30366253
N-[2-(2,5-dimethylphenoxy)ethyl]-5-ethylthiophene-2-sulfonamide
CID 113100868
N-(3-bromopropyl)-5-ethylthiophene-2-sulfonamide
CID 61454391
2-chloro-N-(2-propan-2-yloxyethyl)-1,3-thiazole-5-sulfonamide
CID 104760009
5-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61059652
5-ethyl-N-(2-ethylbutyl)thiophene-2-sulfonamide
CID 115613311
5-ethyl-N-[2-(4-methoxyphenyl)ethyl]thiophene-2-sulfonamide
CID 113098193
N-(2-ethoxyethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide
CID 106020076
5-ethyl-N-[2-[6-(furan-2-yl)pyridazin-3-yl]oxyethyl]thiophene-2-sulfonamide
CID 18588400
N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-5-ethylthiophene-2-sulfonamide
CID 110717928
N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide (CID 110602852) is 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NCCOC(C)C)s1.
What is the InChIKey of 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide?
The InChIKey is VDSZFVQVROZHJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3S2/c1-4-10-5-6-11(16-10)17(13,14)12-7-8-15-9(2)3/h5-6,9,12H,4,7-8H2,1-3H3.
What are the key properties of 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide?
5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide has a molecular weight of 277.41 g/mol, XLogP of 2.01, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 110602852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).