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

C9H10F3N5O2S — CID 60814822

IUPAC2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESNNc1nc2ccccn2c1S(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C9H10F3N5O2S/c10-9(11,12)5-14-20(18,19)8-7(16-13)15-6-3-1-2-4-17(6)8/h1-4,14,16H,5,13H2
InChIKeySADSQYXRWGDYLW-UHFFFAOYSA-N
MW309.27 g/mol
LogP0.46
Rot. Bonds4

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

2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 60814822) has the molecular formula C9H10F3N5O2S and a molecular weight of 309.27 g/mol. Its IUPAC name is 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID60814822
Molecular FormulaC9H10F3N5O2S
Molecular Weight309.27 g/mol
Exact Mass309.05
IUPAC Name2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESNNc1nc2ccccn2c1S(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C9H10F3N5O2S/c10-9(11,12)5-14-20(18,19)8-7(16-13)15-6-3-1-2-4-17(6)8/h1-4,14,16H,5,13H2
InChIKeySADSQYXRWGDYLW-UHFFFAOYSA-N
XLogP0.46
TPSA101.52 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.27
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 60814822) is 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide is NNc1nc2ccccn2c1S(=O)(=O)NCC(F)(F)F.
What is the InChIKey of 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is SADSQYXRWGDYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F3N5O2S/c10-9(11,12)5-14-20(18,19)8-7(16-13)15-6-3-1-2-4-17(6)8/h1-4,14,16H,5,13H2.
What are the key properties of 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 309.27 g/mol, XLogP of 0.46, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 60814822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).