N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide

C10H13NO5S2 — CID 73133417

IUPACN-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(NC1COC2C(O)COC12)c1cccs1
InChIInChI=1S/C10H13NO5S2/c12-7-5-16-9-6(4-15-10(7)9)11-18(13,14)8-2-1-3-17-8/h1-3,6-7,9-12H,4-5H2
InChIKeyJZQLISGEFWNUTL-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.45
Rot. Bonds3

About N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide

N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide (PubChem CID 73133417) has the molecular formula C10H13NO5S2 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide
PubChem CID73133417
Molecular FormulaC10H13NO5S2
Molecular Weight291.35 g/mol
Exact Mass291.02
IUPAC NameN-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(NC1COC2C(O)COC12)c1cccs1
InChIInChI=1S/C10H13NO5S2/c12-7-5-16-9-6(4-15-10(7)9)11-18(13,14)8-2-1-3-17-8/h1-3,6-7,9-12H,4-5H2
InChIKeyJZQLISGEFWNUTL-UHFFFAOYSA-N
XLogP-0.45
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

[(3S,3aS,6S,6aS)-3-(thiophen-2-ylsulfonylamino)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-(4-acetylphenyl)carbamate
CID 162895152
N-[(3R,3aR,6S,6aS)-3-[[4-(3-fluorophenyl)pyrimidin-2-yl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]thiophene-2-sulfonamide
CID 163124064
N-[(3S,3aS,6R,6aR)-6-[4-(phenoxymethyl)triazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]thiophene-2-sulfonamide
CID 163180607
2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid
CID 64816831
[1-[(3S,3aR,6S,6aR)-3-(thiophen-2-ylsulfonylamino)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]triazol-4-yl]methyl-benzyl-methylazanium
CID 11911879
N-(2-aminocycloheptyl)thiophene-2-sulfonamide
CID 63258931
N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]thiophene-2-sulfonamide
CID 103825580
N-[(3R,4S)-4-(3-fluorophenoxy)oxan-3-yl]thiophene-2-sulfonamide
CID 91775771
N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
CID 114147059
N'-hydroxythiophene-2-sulfonohydrazide
CID 67151955
N-[(2R,3S)-2-(1-methylpyrazol-4-yl)oxolan-3-yl]thiophene-2-sulfonamide
CID 128992375
N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)propane-1-sulfonamide
CID 73133421

Frequently Asked Questions

What is the IUPAC name of N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide (CID 73133417) is N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide is O=S(=O)(NC1COC2C(O)COC12)c1cccs1.
What is the InChIKey of N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide?
The InChIKey is JZQLISGEFWNUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO5S2/c12-7-5-16-9-6(4-15-10(7)9)11-18(13,14)8-2-1-3-17-8/h1-3,6-7,9-12H,4-5H2.
What are the key properties of N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide?
N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide has a molecular weight of 291.35 g/mol, XLogP of -0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 73133417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).