N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide

C12H13NO3S2 — CID 110605316

IUPACN-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1ccccc1O)c1cccs1
InChIInChI=1S/C12H13NO3S2/c14-11-5-2-1-4-10(11)7-8-13-18(15,16)12-6-3-9-17-12/h1-6,9,13-14H,7-8H2
InChIKeyXDWZQCNBHWHREX-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.97
Rot. Bonds5

About N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide

N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide (PubChem CID 110605316) has the molecular formula C12H13NO3S2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide
PubChem CID110605316
Molecular FormulaC12H13NO3S2
Molecular Weight283.37 g/mol
Exact Mass283.03
IUPAC NameN-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1ccccc1O)c1cccs1
InChIInChI=1S/C12H13NO3S2/c14-11-5-2-1-4-10(11)7-8-13-18(15,16)12-6-3-9-17-12/h1-6,9,13-14H,7-8H2
InChIKeyXDWZQCNBHWHREX-UHFFFAOYSA-N
XLogP1.97
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2,4-difluorophenyl)ethyl]thiophene-2-sulfonamide
CID 110789033
N-(2-aminooxyethyl)thiophene-2-sulfonamide
CID 39245279
N-(4-phenylbutyl)thiophene-2-sulfonamide
CID 3802488
N-[2-(3-chlorophenyl)ethyl]thiophene-2-sulfonamide
CID 9301774
N-[2-(3,4-dichlorophenyl)ethyl]thiophene-2-sulfonamide
CID 3810708
N-[2-(methylamino)ethyl]thiophene-2-sulfonamide
CID 62658549
3-(thiophen-2-ylsulfonylamino)propanoate
CID 3420084
N-[2-(2,4-dimethoxyphenyl)ethyl]thiophene-2-sulfonamide
CID 110601518
N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]thiophene-2-sulfonamide
CID 110789678
4-bromo-N-[2-(2-hydroxyphenyl)ethyl]benzenesulfonamide
CID 110605294
N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide
CID 113083889
N-(3-hydroxy-3-phenylpropyl)thiophene-2-sulfonamide
CID 90499598

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide (CID 110605316) is N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide is O=S(=O)(NCCc1ccccc1O)c1cccs1.
What is the InChIKey of N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide?
The InChIKey is XDWZQCNBHWHREX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3S2/c14-11-5-2-1-4-10(11)7-8-13-18(15,16)12-6-3-9-17-12/h1-6,9,13-14H,7-8H2.
What are the key properties of N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide?
N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide has a molecular weight of 283.37 g/mol, XLogP of 1.97, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 110605316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).