6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid

C11H10N4O5S — CID 63872600

IUPAC6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)Nc2nnc(C3CC3)o2)nc1
InChIInChI=1S/C11H10N4O5S/c16-10(17)7-3-4-8(12-5-7)21(18,19)15-11-14-13-9(20-11)6-1-2-6/h3-6H,1-2H2,(H,14,15)(H,16,17)
InChIKeyVEEAJOKKHJOHOR-UHFFFAOYSA-N
MW310.29 g/mol
LogP0.84
Rot. Bonds5

About 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid

6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid (PubChem CID 63872600) has the molecular formula C11H10N4O5S and a molecular weight of 310.29 g/mol. Its IUPAC name is 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid
PubChem CID63872600
Molecular FormulaC11H10N4O5S
Molecular Weight310.29 g/mol
Exact Mass310.04
IUPAC Name6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)Nc2nnc(C3CC3)o2)nc1
InChIInChI=1S/C11H10N4O5S/c16-10(17)7-3-4-8(12-5-7)21(18,19)15-11-14-13-9(20-11)6-1-2-6/h3-6H,1-2H2,(H,14,15)(H,16,17)
InChIKeyVEEAJOKKHJOHOR-UHFFFAOYSA-N
XLogP0.84
TPSA135.28 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.29
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid?
The IUPAC name of 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid (CID 63872600) is 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid is O=C(O)c1ccc(S(=O)(=O)Nc2nnc(C3CC3)o2)nc1.
What is the InChIKey of 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid?
The InChIKey is VEEAJOKKHJOHOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O5S/c16-10(17)7-3-4-8(12-5-7)21(18,19)15-11-14-13-9(20-11)6-1-2-6/h3-6H,1-2H2,(H,14,15)(H,16,17).
What are the key properties of 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid?
6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid has a molecular weight of 310.29 g/mol, XLogP of 0.84, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid is sourced from PubChem (CID 63872600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).