N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide

C9H14N4O2S — CID 103300867

IUPACN-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide
SMILESNNc1cccnc1S(=O)(=O)NCC1CC1
InChIInChI=1S/C9H14N4O2S/c10-13-8-2-1-5-11-9(8)16(14,15)12-6-7-3-4-7/h1-2,5,7,12-13H,3-4,6,10H2
InChIKeyTZODJCOXJFQHLF-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.06
Rot. Bonds5

About N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide

N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide (PubChem CID 103300867) has the molecular formula C9H14N4O2S and a molecular weight of 242.30 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide
PubChem CID103300867
Molecular FormulaC9H14N4O2S
Molecular Weight242.30 g/mol
Exact Mass242.08
IUPAC NameN-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide
SMILESNNc1cccnc1S(=O)(=O)NCC1CC1
InChIInChI=1S/C9H14N4O2S/c10-13-8-2-1-5-11-9(8)16(14,15)12-6-7-3-4-7/h1-2,5,7,12-13H,3-4,6,10H2
InChIKeyTZODJCOXJFQHLF-UHFFFAOYSA-N
XLogP0.06
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.06
H-Bond Donors ≤ 53
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-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide (CID 103300867) is N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide is NNc1cccnc1S(=O)(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide?
The InChIKey is TZODJCOXJFQHLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2S/c10-13-8-2-1-5-11-9(8)16(14,15)12-6-7-3-4-7/h1-2,5,7,12-13H,3-4,6,10H2.
What are the key properties of N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide?
N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide has a molecular weight of 242.30 g/mol, XLogP of 0.06, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-hydrazinylpyridine-2-sulfonamide is sourced from PubChem (CID 103300867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).