5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide

C9H10ClN5O3S — CID 81177707

IUPAC5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)NCc2ccon2)cc1Cl
InChIInChI=1S/C9H10ClN5O3S/c10-8-3-7(5-12-9(8)14-11)19(16,17)13-4-6-1-2-18-15-6/h1-3,5,13H,4,11H2,(H,12,14)
InChIKeyWCCDQXTVQHFRPG-UHFFFAOYSA-N
MW303.73 g/mol
LogP0.49
Rot. Bonds5

About 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide

5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide (PubChem CID 81177707) has the molecular formula C9H10ClN5O3S and a molecular weight of 303.73 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide
PubChem CID81177707
Molecular FormulaC9H10ClN5O3S
Molecular Weight303.73 g/mol
Exact Mass303.02
IUPAC Name5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide
SMILESNNc1ncc(S(=O)(=O)NCc2ccon2)cc1Cl
InChIInChI=1S/C9H10ClN5O3S/c10-8-3-7(5-12-9(8)14-11)19(16,17)13-4-6-1-2-18-15-6/h1-3,5,13H,4,11H2,(H,12,14)
InChIKeyWCCDQXTVQHFRPG-UHFFFAOYSA-N
XLogP0.49
TPSA123.14 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.73
LogP ≤ 50.49
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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Related Compounds

5-chloro-6-hydrazinyl-N-(pyrimidin-4-ylmethyl)pyridine-3-sulfonamide
CID 114111350
2-amino-N-(1,2-oxazol-3-ylmethyl)pyrimidine-5-sulfonamide
CID 81176880
5-chloro-6-hydrazinyl-N-(pyridin-3-ylmethyl)pyridine-3-sulfonamide
CID 64607977
5-chloro-6-hydrazinyl-N-propylpyridine-3-sulfonamide
CID 64607208
5-chloro-6-hydrazinyl-N-[(3-methylphenyl)methyl]pyridine-3-sulfonamide
CID 64607222
5-chloro-6-hydrazinyl-N-(1H-pyrazol-4-ylmethyl)pyridine-3-sulfonamide
CID 64607994
5-chloro-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-6-hydrazinylpyridine-3-sulfonamide
CID 106373397
4-bromo-2-chloro-N-(1,2-oxazol-3-ylmethyl)benzenesulfonamide
CID 79477882
4-chloro-3-nitro-N-(1,2-oxazol-3-ylmethyl)benzenesulfonamide
CID 81170213
2-chloro-N-(1,2-oxazol-3-ylmethyl)-1,3-thiazole-5-sulfonamide
CID 81170323
5-chloro-6-hydrazinyl-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64608544
5-chloro-N-(2-ethoxyethyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608939

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide (CID 81177707) is 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide is NNc1ncc(S(=O)(=O)NCc2ccon2)cc1Cl.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide?
The InChIKey is WCCDQXTVQHFRPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN5O3S/c10-8-3-7(5-12-9(8)14-11)19(16,17)13-4-6-1-2-18-15-6/h1-3,5,13H,4,11H2,(H,12,14).
What are the key properties of 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide?
5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide has a molecular weight of 303.73 g/mol, XLogP of 0.49, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-(1,2-oxazol-3-ylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 81177707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).