5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide

C10H14ClNO3S2 — CID 95984008

IUPAC5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide
SMILESO=S(=O)(N[C@H]1CCC[C@@H](O)C1)c1ccc(Cl)s1
InChIInChI=1S/C10H14ClNO3S2/c11-9-4-5-10(16-9)17(14,15)12-7-2-1-3-8(13)6-7/h4-5,7-8,12-13H,1-3,6H2/t7-,8+/m0/s1
InChIKeyWRKJYHMDXJYSCB-JGVFFNPUSA-N
MW295.81 g/mol
LogP1.98
Rot. Bonds3

About 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide

5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide (PubChem CID 95984008) has the molecular formula C10H14ClNO3S2 and a molecular weight of 295.81 g/mol. Its IUPAC name is 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide
PubChem CID95984008
Molecular FormulaC10H14ClNO3S2
Molecular Weight295.81 g/mol
Exact Mass295.01
IUPAC Name5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide
SMILESO=S(=O)(N[C@H]1CCC[C@@H](O)C1)c1ccc(Cl)s1
InChIInChI=1S/C10H14ClNO3S2/c11-9-4-5-10(16-9)17(14,15)12-7-2-1-3-8(13)6-7/h4-5,7-8,12-13H,1-3,6H2/t7-,8+/m0/s1
InChIKeyWRKJYHMDXJYSCB-JGVFFNPUSA-N
XLogP1.98
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(3-hydroxycyclohexyl)-1,3-thiazole-5-sulfonamide
CID 61051756
5-chloro-N-[(1R,2S)-2-(cyclopentylamino)cyclobutyl]thiophene-2-sulfonamide
CID 133130662
N-(2-bromocyclopentyl)-5-chlorothiophene-2-sulfonamide
CID 80662650
N-(3-aminocyclobutyl)-5-chlorothiophene-2-sulfonamide
CID 43597846
N-(2-adamantyl)-5-chlorothiophene-2-sulfonamide
CID 22204431
5-chloro-N-piperidin-4-ylthiophene-2-sulfonamide
CID 28811036
5-chloro-N-pyrrolidin-3-ylthiophene-2-sulfonamide
CID 62380456
5-chloro-N-(3,3-dimethylcyclopentyl)thiophene-2-sulfonamide
CID 115881167
3-chloro-4-fluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide
CID 95984027
5-chloro-N-[(1S,3S)-3-hydroxycyclohexyl]-2-methylbenzenesulfonamide
CID 95984034
2,6-difluoro-N-[(1S,3S)-3-hydroxycyclohexyl]benzenesulfonamide
CID 95984042
2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide
CID 95984043

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide (CID 95984008) is 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide is O=S(=O)(N[C@H]1CCC[C@@H](O)C1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide?
The InChIKey is WRKJYHMDXJYSCB-JGVFFNPUSA-N. The full InChI is InChI=1S/C10H14ClNO3S2/c11-9-4-5-10(16-9)17(14,15)12-7-2-1-3-8(13)6-7/h4-5,7-8,12-13H,1-3,6H2/t7-,8+/m0/s1.
What are the key properties of 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide?
5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide has a molecular weight of 295.81 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide is sourced from PubChem (CID 95984008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).