5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide

C11H18ClNO3S2 — CID 103836355

IUPAC5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide
SMILESCCCC(CCO)CNS(=O)(=O)c1ccc(Cl)s1
InChIInChI=1S/C11H18ClNO3S2/c1-2-3-9(6-7-14)8-13-18(15,16)11-5-4-10(12)17-11/h4-5,9,13-14H,2-3,6-8H2,1H3
InChIKeyWOVGPUVIZPEFEP-UHFFFAOYSA-N
MW311.86 g/mol
LogP2.48
Rot. Bonds8

About 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide

5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide (PubChem CID 103836355) has the molecular formula C11H18ClNO3S2 and a molecular weight of 311.86 g/mol. Its IUPAC name is 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide
PubChem CID103836355
Molecular FormulaC11H18ClNO3S2
Molecular Weight311.86 g/mol
Exact Mass311.04
IUPAC Name5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide
SMILESCCCC(CCO)CNS(=O)(=O)c1ccc(Cl)s1
InChIInChI=1S/C11H18ClNO3S2/c1-2-3-9(6-7-14)8-13-18(15,16)11-5-4-10(12)17-11/h4-5,9,13-14H,2-3,6-8H2,1H3
InChIKeyWOVGPUVIZPEFEP-UHFFFAOYSA-N
XLogP2.48
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.86
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-hydroxyethyl)pentyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103847971
3-[(5-chlorothiophen-2-yl)sulfonylamino]-2-hydroxypropanamide
CID 107258327
2,4,6-trichloro-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide
CID 103836427
3-chloro-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide
CID 103836329
N-(2-bromo-3-ethylpentyl)-5-chlorothiophene-2-sulfonamide
CID 106288687
4-acetyl-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide
CID 103836399
2-amino-5-bromo-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide
CID 106113439
5-amino-2-chloro-4-fluoro-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide
CID 106113557
5-chloro-N-heptylthiophene-2-sulfonamide
CID 19681281
5-chloro-N-(1-hydroxyheptan-2-yl)thiophene-2-sulfonamide
CID 68540037
4-ethoxy-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide
CID 103836328
2-amino-3-fluoro-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide
CID 106113489

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide (CID 103836355) is 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide is CCCC(CCO)CNS(=O)(=O)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide?
The InChIKey is WOVGPUVIZPEFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClNO3S2/c1-2-3-9(6-7-14)8-13-18(15,16)11-5-4-10(12)17-11/h4-5,9,13-14H,2-3,6-8H2,1H3.
What are the key properties of 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide?
5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide has a molecular weight of 311.86 g/mol, XLogP of 2.48, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(2-hydroxyethyl)pentyl]thiophene-2-sulfonamide is sourced from PubChem (CID 103836355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).