2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide

C8H12N2O5S — CID 86115167

IUPAC2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1OCC(O)CO
InChIInChI=1S/C8H12N2O5S/c9-16(13,14)7-2-1-3-10-8(7)15-5-6(12)4-11/h1-3,6,11-12H,4-5H2,(H2,9,13,14)
InChIKeyDYMRPAYQYWDUHQ-UHFFFAOYSA-N
MW248.26 g/mol
LogP-1.54
Rot. Bonds5

About 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide

2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide (PubChem CID 86115167) has the molecular formula C8H12N2O5S and a molecular weight of 248.26 g/mol. Its IUPAC name is 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide
PubChem CID86115167
Molecular FormulaC8H12N2O5S
Molecular Weight248.26 g/mol
Exact Mass248.05
IUPAC Name2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1OCC(O)CO
InChIInChI=1S/C8H12N2O5S/c9-16(13,14)7-2-1-3-10-8(7)15-5-6(12)4-11/h1-3,6,11-12H,4-5H2,(H2,9,13,14)
InChIKeyDYMRPAYQYWDUHQ-UHFFFAOYSA-N
XLogP-1.54
TPSA122.74 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.26
LogP ≤ 5-1.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2,3-dihydroxypropoxy)pyridine-3-carbonitrile
CID 12529033
2-hexoxypyridine-3-sulfonamide
CID 112572977
3-[(2-bromo-3-pyridinyl)oxy]propane-1,2-diol
CID 20607341
2-(4-methoxyphenoxy)pyridine-3-sulfonamide
CID 112572912
2-(2-methoxyphenoxy)pyridine-3-sulfonamide
CID 112572908
2-[[(2S)-1-hydroxybutan-2-yl]amino]pyridine-3-sulfonamide
CID 133434655
2-(2,3-dihydroxypropylsulfanyl)benzenesulfonamide
CID 79682078
2-(4-methylsulfonylphenoxy)pyridine-3-sulfonamide
CID 115928497
N-[2-[(3-sulfamoyl-2-pyridinyl)oxy]phenyl]acetamide
CID 115928437
2-(2,5-dimethylphenoxy)pyridine-3-sulfonamide
CID 112572887
2-(3,4-difluorophenoxy)pyridine-3-sulfonamide
CID 112573012
2-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-sulfonamide
CID 112573106

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide?
The IUPAC name of 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide (CID 86115167) is 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide?
The canonical SMILES for 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide is NS(=O)(=O)c1cccnc1OCC(O)CO.
What is the InChIKey of 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide?
The InChIKey is DYMRPAYQYWDUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O5S/c9-16(13,14)7-2-1-3-10-8(7)15-5-6(12)4-11/h1-3,6,11-12H,4-5H2,(H2,9,13,14).
What are the key properties of 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide?
2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide has a molecular weight of 248.26 g/mol, XLogP of -1.54, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroxypropoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 86115167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).