5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide

C10H14BrNO3S2 — CID 43389482

IUPAC5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NC1CCC(O)CC1)c1ccc(Br)s1
InChIInChI=1S/C10H14BrNO3S2/c11-9-5-6-10(16-9)17(14,15)12-7-1-3-8(13)4-2-7/h5-8,12-13H,1-4H2
InChIKeyHDRAJXXRNANSRC-UHFFFAOYSA-N
MW340.26 g/mol
LogP2.09
Rot. Bonds3

About 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide

5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide (PubChem CID 43389482) has the molecular formula C10H14BrNO3S2 and a molecular weight of 340.26 g/mol. Its IUPAC name is 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide
PubChem CID43389482
Molecular FormulaC10H14BrNO3S2
Molecular Weight340.26 g/mol
Exact Mass338.96
IUPAC Name5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NC1CCC(O)CC1)c1ccc(Br)s1
InChIInChI=1S/C10H14BrNO3S2/c11-9-5-6-10(16-9)17(14,15)12-7-1-3-8(13)4-2-7/h5-8,12-13H,1-4H2
InChIKeyHDRAJXXRNANSRC-UHFFFAOYSA-N
XLogP2.09
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.26
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-(4-hydroxycyclohexyl)thiophene-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 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide?
The IUPAC name of 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide (CID 43389482) is 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide is O=S(=O)(NC1CCC(O)CC1)c1ccc(Br)s1.
What is the InChIKey of 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide?
The InChIKey is HDRAJXXRNANSRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNO3S2/c11-9-5-6-10(16-9)17(14,15)12-7-1-3-8(13)4-2-7/h5-8,12-13H,1-4H2.
What are the key properties of 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide?
5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide has a molecular weight of 340.26 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-hydroxycyclohexyl)thiophene-2-sulfonamide is sourced from PubChem (CID 43389482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).