N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide

C11H20N4O2S — CID 43383623

IUPACN-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide
SMILESCCCCN(CC)S(=O)(=O)c1cccnc1NN
InChIInChI=1S/C11H20N4O2S/c1-3-5-9-15(4-2)18(16,17)10-7-6-8-13-11(10)14-12/h6-8H,3-5,9,12H2,1-2H3,(H,13,14)
InChIKeyFUHZWYQLGCUDNX-UHFFFAOYSA-N
MW272.37 g/mol
LogP1.18
Rot. Bonds7

About N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide

N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide (PubChem CID 43383623) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide
PubChem CID43383623
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC NameN-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide
SMILESCCCCN(CC)S(=O)(=O)c1cccnc1NN
InChIInChI=1S/C11H20N4O2S/c1-3-5-9-15(4-2)18(16,17)10-7-6-8-13-11(10)14-12/h6-8H,3-5,9,12H2,1-2H3,(H,13,14)
InChIKeyFUHZWYQLGCUDNX-UHFFFAOYSA-N
XLogP1.18
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide (CID 43383623) is N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide is CCCCN(CC)S(=O)(=O)c1cccnc1NN.
What is the InChIKey of N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide?
The InChIKey is FUHZWYQLGCUDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-3-5-9-15(4-2)18(16,17)10-7-6-8-13-11(10)14-12/h6-8H,3-5,9,12H2,1-2H3,(H,13,14).
What are the key properties of N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide?
N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 1.18, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethyl-2-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 43383623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).