5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide

C10H17NO5S — CID 102701313

IUPAC5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide
SMILESCOC(C)CNS(=O)(=O)c1cc(CO)oc1C
InChIInChI=1S/C10H17NO5S/c1-7(15-3)5-11-17(13,14)10-4-9(6-12)16-8(10)2/h4,7,11-12H,5-6H2,1-3H3
InChIKeySXYZKFPKHILXOR-UHFFFAOYSA-N
MW263.31 g/mol
LogP0.39
Rot. Bonds6

About 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide

5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide (PubChem CID 102701313) has the molecular formula C10H17NO5S and a molecular weight of 263.31 g/mol. Its IUPAC name is 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide.

Molecular Properties

Compound Name5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide
PubChem CID102701313
Molecular FormulaC10H17NO5S
Molecular Weight263.31 g/mol
Exact Mass263.08
IUPAC Name5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide
SMILESCOC(C)CNS(=O)(=O)c1cc(CO)oc1C
InChIInChI=1S/C10H17NO5S/c1-7(15-3)5-11-17(13,14)10-4-9(6-12)16-8(10)2/h4,7,11-12H,5-6H2,1-3H3
InChIKeySXYZKFPKHILXOR-UHFFFAOYSA-N
XLogP0.39
TPSA88.77 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.31
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(hydroxymethyl)-2-methyl-N-(2,3,3-trimethylbutyl)furan-3-sulfonamide
CID 83147038
5-[(cyclopropylamino)methyl]-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide
CID 102701683
5-(hydroxymethyl)-2-methyl-N-(4-propan-2-yloxybutyl)furan-3-sulfonamide
CID 106014493
3-bromo-5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylbenzenesulfonamide
CID 102701305
N-(3-ethoxypropyl)-5-(hydroxymethyl)-2-methylfuran-3-sulfonamide
CID 114133466
N-[2-(2,2-difluoroethoxy)ethyl]-5-(hydroxymethyl)-2-methylfuran-3-sulfonamide
CID 106001563
5-(hydroxymethyl)-N-(1-methoxybutan-2-yl)-2-methylfuran-3-sulfonamide
CID 114135110
2-bromo-N-(2-methoxypropyl)-4-methylbenzenesulfonamide
CID 102697677
N-[3-(dimethylamino)-2,2-dimethylpropyl]-5-(hydroxymethyl)-2-methylfuran-3-sulfonamide
CID 107473844
5-(hydroxymethyl)-2-methyl-N-[2-(trifluoromethylsulfanyl)ethyl]furan-3-sulfonamide
CID 106433689
5-amino-2-methoxy-N-(2-methoxypropyl)-4-methylbenzenesulfonamide
CID 102694373
3-amino-5-chloro-N-(2-methoxypropyl)-2-methylbenzenesulfonamide
CID 102694349

Frequently Asked Questions

What is the IUPAC name of 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide?
The IUPAC name of 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide (CID 102701313) is 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide.
What is the SMILES notation for 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide?
The canonical SMILES for 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide is COC(C)CNS(=O)(=O)c1cc(CO)oc1C.
What is the InChIKey of 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide?
The InChIKey is SXYZKFPKHILXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO5S/c1-7(15-3)5-11-17(13,14)10-4-9(6-12)16-8(10)2/h4,7,11-12H,5-6H2,1-3H3.
What are the key properties of 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide?
5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide has a molecular weight of 263.31 g/mol, XLogP of 0.39, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydroxymethyl)-N-(2-methoxypropyl)-2-methylfuran-3-sulfonamide is sourced from PubChem (CID 102701313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).