5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide

C11H15NO5S — CID 114148606

IUPAC5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide
SMILESO=Cc1ccc(S(=O)(=O)NCC2CCC(O)C2)o1
InChIInChI=1S/C11H15NO5S/c13-7-10-3-4-11(17-10)18(15,16)12-6-8-1-2-9(14)5-8/h3-4,7-9,12,14H,1-2,5-6H2
InChIKeyNEPMLAMJERINEY-UHFFFAOYSA-N
MW273.31 g/mol
LogP0.53
Rot. Bonds5

About 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide

5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide (PubChem CID 114148606) has the molecular formula C11H15NO5S and a molecular weight of 273.31 g/mol. Its IUPAC name is 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide.

Molecular Properties

Compound Name5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide
PubChem CID114148606
Molecular FormulaC11H15NO5S
Molecular Weight273.31 g/mol
Exact Mass273.07
IUPAC Name5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide
SMILESO=Cc1ccc(S(=O)(=O)NCC2CCC(O)C2)o1
InChIInChI=1S/C11H15NO5S/c13-7-10-3-4-11(17-10)18(15,16)12-6-8-1-2-9(14)5-8/h3-4,7-9,12,14H,1-2,5-6H2
InChIKeyNEPMLAMJERINEY-UHFFFAOYSA-N
XLogP0.53
TPSA96.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide
CID 106137735
4-chloro-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 54351747
3,4-difluoro-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 103270285
3-chloro-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 103270183
5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide
CID 66007251
2-amino-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 103270335
3-amino-2,4-dichloro-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 106119157
5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide
CID 106295742
N-[(3-hydroxycyclopentyl)methyl]-2,3,5,6-tetramethylbenzenesulfonamide
CID 103270305
2-[5-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophen-2-yl]acetic acid
CID 106120467
5-formyl-N-[3-(2-hydroxyethoxy)propyl]furan-2-sulfonamide
CID 114172010
N-[4-[(3-hydroxycyclopentyl)methylsulfamoyl]phenyl]acetamide
CID 103270149

Frequently Asked Questions

What is the IUPAC name of 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide?
The IUPAC name of 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide (CID 114148606) is 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide.
What is the SMILES notation for 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide?
The canonical SMILES for 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide is O=Cc1ccc(S(=O)(=O)NCC2CCC(O)C2)o1.
What is the InChIKey of 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide?
The InChIKey is NEPMLAMJERINEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO5S/c13-7-10-3-4-11(17-10)18(15,16)12-6-8-1-2-9(14)5-8/h3-4,7-9,12,14H,1-2,5-6H2.
What are the key properties of 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide?
5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide has a molecular weight of 273.31 g/mol, XLogP of 0.53, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide is sourced from PubChem (CID 114148606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).