N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide

C11H13N5O2S2 — CID 61480808

IUPACN-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ccc(S(=O)(=O)Nc2nc(C3CC3)cs2)cn1
InChIInChI=1S/C11H13N5O2S2/c12-15-10-4-3-8(5-13-10)20(17,18)16-11-14-9(6-19-11)7-1-2-7/h3-7H,1-2,12H2,(H,13,15)(H,14,16)
InChIKeyMOCJPGKUYJRFMI-UHFFFAOYSA-N
MW311.39 g/mol
LogP1.50
Rot. Bonds5

About N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide

N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide (PubChem CID 61480808) has the molecular formula C11H13N5O2S2 and a molecular weight of 311.39 g/mol. Its IUPAC name is N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide
PubChem CID61480808
Molecular FormulaC11H13N5O2S2
Molecular Weight311.39 g/mol
Exact Mass311.05
IUPAC NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ccc(S(=O)(=O)Nc2nc(C3CC3)cs2)cn1
InChIInChI=1S/C11H13N5O2S2/c12-15-10-4-3-8(5-13-10)20(17,18)16-11-14-9(6-19-11)7-1-2-7/h3-7H,1-2,12H2,(H,13,15)(H,14,16)
InChIKeyMOCJPGKUYJRFMI-UHFFFAOYSA-N
XLogP1.50
TPSA110.00 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide (CID 61480808) is N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide is NNc1ccc(S(=O)(=O)Nc2nc(C3CC3)cs2)cn1.
What is the InChIKey of N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide?
The InChIKey is MOCJPGKUYJRFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O2S2/c12-15-10-4-3-8(5-13-10)20(17,18)16-11-14-9(6-19-11)7-1-2-7/h3-7H,1-2,12H2,(H,13,15)(H,14,16).
What are the key properties of N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide?
N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide has a molecular weight of 311.39 g/mol, XLogP of 1.50, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 61480808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).