2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide

C12H17N5O3S — CID 60812816

IUPAC2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESNNc1nc2ccccn2c1S(=O)(=O)NCC1CCCO1
InChIInChI=1S/C12H17N5O3S/c13-16-11-12(17-6-2-1-5-10(17)15-11)21(18,19)14-8-9-4-3-7-20-9/h1-2,5-6,9,14,16H,3-4,7-8,13H2
InChIKeyFCXXGRJSLCVESV-UHFFFAOYSA-N
MW311.37 g/mol
LogP0.08
Rot. Bonds5

About 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 60812816) has the molecular formula C12H17N5O3S and a molecular weight of 311.37 g/mol. Its IUPAC name is 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID60812816
Molecular FormulaC12H17N5O3S
Molecular Weight311.37 g/mol
Exact Mass311.11
IUPAC Name2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESNNc1nc2ccccn2c1S(=O)(=O)NCC1CCCO1
InChIInChI=1S/C12H17N5O3S/c13-16-11-12(17-6-2-1-5-10(17)15-11)21(18,19)14-8-9-4-3-7-20-9/h1-2,5-6,9,14,16H,3-4,7-8,13H2
InChIKeyFCXXGRJSLCVESV-UHFFFAOYSA-N
XLogP0.08
TPSA110.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.37
LogP ≤ 50.08
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-hydrazinyl-N-(2-methoxyethyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 60814826
2-hydrazinyl-N-(2-propan-2-yloxyethyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 104762785
2-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridine-3-carbonitrile
CID 133462550
[1-(2-hydrazinylimidazo[1,2-a]pyridin-3-yl)sulfonylpyrrolidin-2-yl]methanol
CID 61409852
(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 4-chloro-3-(oxolan-2-ylmethylsulfamoyl)benzoate
CID 42921258
2-chloro-N-(cyclopentylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 47254422
[3-(2-methylmorpholin-4-yl)sulfonylimidazo[1,2-a]pyridin-2-yl]hydrazine
CID 60813816
1-(2-hydrazinylimidazo[1,2-a]pyridin-3-yl)sulfonylpyrrolidine-3,4-diol
CID 106670070
2-hydrazinyl-N-pyrimidin-5-ylimidazo[1,2-a]pyridine-3-sulfonamide
CID 107588983
2-chloro-N-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 47298748
2-fluoro-N-[[(2R)-oxolan-2-yl]methyl]benzenesulfonamide
CID 2123351
N-[[(2S)-oxolan-2-yl]methyl]quinoline-8-sulfonamide
CID 704975

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 60812816) is 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide is NNc1nc2ccccn2c1S(=O)(=O)NCC1CCCO1.
What is the InChIKey of 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is FCXXGRJSLCVESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O3S/c13-16-11-12(17-6-2-1-5-10(17)15-11)21(18,19)14-8-9-4-3-7-20-9/h1-2,5-6,9,14,16H,3-4,7-8,13H2.
What are the key properties of 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 311.37 g/mol, XLogP of 0.08, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 60812816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).