5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide

C10H12ClN5O3S — CID 65486622

IUPAC5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide
SMILESCc1noc(NS(=O)(=O)c2cnc(NN)c(Cl)c2)c1C
InChIInChI=1S/C10H12ClN5O3S/c1-5-6(2)15-19-10(5)16-20(17,18)7-3-8(11)9(14-12)13-4-7/h3-4,16H,12H2,1-2H3,(H,13,14)
InChIKeyDAEFEHHDTKDVAF-UHFFFAOYSA-N
MW317.76 g/mol
LogP1.43
Rot. Bonds4

About 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide

5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide (PubChem CID 65486622) has the molecular formula C10H12ClN5O3S and a molecular weight of 317.76 g/mol. Its IUPAC name is 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide
PubChem CID65486622
Molecular FormulaC10H12ClN5O3S
Molecular Weight317.76 g/mol
Exact Mass317.03
IUPAC Name5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide
SMILESCc1noc(NS(=O)(=O)c2cnc(NN)c(Cl)c2)c1C
InChIInChI=1S/C10H12ClN5O3S/c1-5-6(2)15-19-10(5)16-20(17,18)7-3-8(11)9(14-12)13-4-7/h3-4,16H,12H2,1-2H3,(H,13,14)
InChIKeyDAEFEHHDTKDVAF-UHFFFAOYSA-N
XLogP1.43
TPSA123.14 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.76
LogP ≤ 51.43
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

2-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)pyrimidine-5-sulfonamide
CID 65486818
5-chloro-6-hydrazinyl-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64608544
5-chloro-N-(2-chloro-4-methylphenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608552
5-chloro-6-hydrazinyl-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide
CID 79240791
4-amino-2,6-dichloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 65488136
3-chloro-4-cyano-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 115698046
5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide
CID 64607395
N-(4-bromophenyl)-5-chloro-6-hydrazinylpyridine-3-sulfonamide
CID 64607594
5-chloro-6-hydrazinyl-N-(4-methylsulfanylphenyl)pyridine-3-sulfonamide
CID 64607396
4-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 5344
4-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylbenzenesulfonamide
CID 65487179
5-chloro-6-hydrazinyl-N-propylpyridine-3-sulfonamide
CID 64607208

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide (CID 65486622) is 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide is Cc1noc(NS(=O)(=O)c2cnc(NN)c(Cl)c2)c1C.
What is the InChIKey of 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide?
The InChIKey is DAEFEHHDTKDVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN5O3S/c1-5-6(2)15-19-10(5)16-20(17,18)7-3-8(11)9(14-12)13-4-7/h3-4,16H,12H2,1-2H3,(H,13,14).
What are the key properties of 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide?
5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide has a molecular weight of 317.76 g/mol, XLogP of 1.43, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3,4-dimethyl-1,2-oxazol-5-yl)-6-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 65486622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).