N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide

C10H17NO3S2 — CID 71160507

IUPACN,N,4-triethyl-3-hydroxythiophene-2-sulfonamide
SMILESCCc1csc(S(=O)(=O)N(CC)CC)c1O
InChIInChI=1S/C10H17NO3S2/c1-4-8-7-15-10(9(8)12)16(13,14)11(5-2)6-3/h7,12H,4-6H2,1-3H3
InChIKeyLYVKVPQLNPMPQH-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.05
Rot. Bonds5

About N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide

N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide (PubChem CID 71160507) has the molecular formula C10H17NO3S2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide.

Molecular Properties

Compound NameN,N,4-triethyl-3-hydroxythiophene-2-sulfonamide
PubChem CID71160507
Molecular FormulaC10H17NO3S2
Molecular Weight263.38 g/mol
Exact Mass263.06
IUPAC NameN,N,4-triethyl-3-hydroxythiophene-2-sulfonamide
SMILESCCc1csc(S(=O)(=O)N(CC)CC)c1O
InChIInChI=1S/C10H17NO3S2/c1-4-8-7-15-10(9(8)12)16(13,14)11(5-2)6-3/h7,12H,4-6H2,1-3H3
InChIKeyLYVKVPQLNPMPQH-UHFFFAOYSA-N
XLogP2.05
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiophene_hydroxy(28)', 'substructure': 'N/A'}

Analyze N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide?
The IUPAC name of N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide (CID 71160507) is N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide.
What is the SMILES notation for N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide?
The canonical SMILES for N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide is CCc1csc(S(=O)(=O)N(CC)CC)c1O.
What is the InChIKey of N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide?
The InChIKey is LYVKVPQLNPMPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3S2/c1-4-8-7-15-10(9(8)12)16(13,14)11(5-2)6-3/h7,12H,4-6H2,1-3H3.
What are the key properties of N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide?
N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide has a molecular weight of 263.38 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-triethyl-3-hydroxythiophene-2-sulfonamide is sourced from PubChem (CID 71160507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).