4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide

C11H15N7O3S — CID 118266125

IUPAC4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide
SMILESNS(=O)(=O)c1nccc(N2CCC(O)CC2)c1-c1nn[nH]n1
InChIInChI=1S/C11H15N7O3S/c12-22(20,21)11-9(10-14-16-17-15-10)8(1-4-13-11)18-5-2-7(19)3-6-18/h1,4,7,19H,2-3,5-6H2,(H2,12,20,21)(H,14,15,16,17)
InChIKeyTZKKMSMZYMBICL-UHFFFAOYSA-N
MW325.35 g/mol
LogP-1.13
Rot. Bonds3

About 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide

4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide (PubChem CID 118266125) has the molecular formula C11H15N7O3S and a molecular weight of 325.35 g/mol. Its IUPAC name is 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide
PubChem CID118266125
Molecular FormulaC11H15N7O3S
Molecular Weight325.35 g/mol
Exact Mass325.10
IUPAC Name4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide
SMILESNS(=O)(=O)c1nccc(N2CCC(O)CC2)c1-c1nn[nH]n1
InChIInChI=1S/C11H15N7O3S/c12-22(20,21)11-9(10-14-16-17-15-10)8(1-4-13-11)18-5-2-7(19)3-6-18/h1,4,7,19H,2-3,5-6H2,(H2,12,20,21)(H,14,15,16,17)
InChIKeyTZKKMSMZYMBICL-UHFFFAOYSA-N
XLogP-1.13
TPSA150.98 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.35
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
The IUPAC name of 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide (CID 118266125) is 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
The canonical SMILES for 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide is NS(=O)(=O)c1nccc(N2CCC(O)CC2)c1-c1nn[nH]n1.
What is the InChIKey of 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
The InChIKey is TZKKMSMZYMBICL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O3S/c12-22(20,21)11-9(10-14-16-17-15-10)8(1-4-13-11)18-5-2-7(19)3-6-18/h1,4,7,19H,2-3,5-6H2,(H2,12,20,21)(H,14,15,16,17).
What are the key properties of 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide has a molecular weight of 325.35 g/mol, XLogP of -1.13, 3 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxypiperidin-1-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 118266125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).