5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide

C15H19NO3S2 — CID 87031963

IUPAC5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCCc2ccccc2OC)s1
InChIInChI=1S/C15H19NO3S2/c1-3-13-8-9-15(20-13)21(17,18)16-11-10-12-6-4-5-7-14(12)19-2/h4-9,16H,3,10-11H2,1-2H3
InChIKeyRIWCZZSXWDXDIR-UHFFFAOYSA-N
MW325.45 g/mol
LogP2.84
Rot. Bonds7

About 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide

5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide (PubChem CID 87031963) has the molecular formula C15H19NO3S2 and a molecular weight of 325.45 g/mol. Its IUPAC name is 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide
PubChem CID87031963
Molecular FormulaC15H19NO3S2
Molecular Weight325.45 g/mol
Exact Mass325.08
IUPAC Name5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCCc2ccccc2OC)s1
InChIInChI=1S/C15H19NO3S2/c1-3-13-8-9-15(20-13)21(17,18)16-11-10-12-6-4-5-7-14(12)19-2/h4-9,16H,3,10-11H2,1-2H3
InChIKeyRIWCZZSXWDXDIR-UHFFFAOYSA-N
XLogP2.84
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.45
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide (CID 87031963) is 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NCCc2ccccc2OC)s1.
What is the InChIKey of 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide?
The InChIKey is RIWCZZSXWDXDIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3S2/c1-3-13-8-9-15(20-13)21(17,18)16-11-10-12-6-4-5-7-14(12)19-2/h4-9,16H,3,10-11H2,1-2H3.
What are the key properties of 5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide?
5-ethyl-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide has a molecular weight of 325.45 g/mol, XLogP of 2.84, 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-(2-methoxyphenyl)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 87031963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).