N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide

C12H18N4O3S — CID 114119947

IUPACN-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide
SMILESNNc1cccnc1S(=O)(=O)NC1CCOC1C1CC1
InChIInChI=1S/C12H18N4O3S/c13-15-10-2-1-6-14-12(10)20(17,18)16-9-5-7-19-11(9)8-3-4-8/h1-2,6,8-9,11,15-16H,3-5,7,13H2
InChIKeyJUYHWDXXZVHRJT-UHFFFAOYSA-N
MW298.37 g/mol
LogP0.21
Rot. Bonds5

About N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide

N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide (PubChem CID 114119947) has the molecular formula C12H18N4O3S and a molecular weight of 298.37 g/mol. Its IUPAC name is N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide
PubChem CID114119947
Molecular FormulaC12H18N4O3S
Molecular Weight298.37 g/mol
Exact Mass298.11
IUPAC NameN-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide
SMILESNNc1cccnc1S(=O)(=O)NC1CCOC1C1CC1
InChIInChI=1S/C12H18N4O3S/c13-15-10-2-1-6-14-12(10)20(17,18)16-9-5-7-19-11(9)8-3-4-8/h1-2,6,8-9,11,15-16H,3-5,7,13H2
InChIKeyJUYHWDXXZVHRJT-UHFFFAOYSA-N
XLogP0.21
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 50.21
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 N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide?
The IUPAC name of N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide (CID 114119947) is N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide.
What is the SMILES notation for N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide?
The canonical SMILES for N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide is NNc1cccnc1S(=O)(=O)NC1CCOC1C1CC1.
What is the InChIKey of N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide?
The InChIKey is JUYHWDXXZVHRJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3S/c13-15-10-2-1-6-14-12(10)20(17,18)16-9-5-7-19-11(9)8-3-4-8/h1-2,6,8-9,11,15-16H,3-5,7,13H2.
What are the key properties of N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide?
N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide has a molecular weight of 298.37 g/mol, XLogP of 0.21, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyloxolan-3-yl)-3-hydrazinylpyridine-2-sulfonamide is sourced from PubChem (CID 114119947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).