2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide

C11H19N3O3S — CID 64605089

IUPAC2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide
SMILESCOCCC(C)NS(=O)(=O)c1ccccc1NN
InChIInChI=1S/C11H19N3O3S/c1-9(7-8-17-2)14-18(15,16)11-6-4-3-5-10(11)13-12/h3-6,9,13-14H,7-8,12H2,1-2H3
InChIKeyTXLYNCCLYSMIRO-UHFFFAOYSA-N
MW273.36 g/mol
LogP0.68
Rot. Bonds7

About 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide

2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide (PubChem CID 64605089) has the molecular formula C11H19N3O3S and a molecular weight of 273.36 g/mol. Its IUPAC name is 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide
PubChem CID64605089
Molecular FormulaC11H19N3O3S
Molecular Weight273.36 g/mol
Exact Mass273.11
IUPAC Name2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide
SMILESCOCCC(C)NS(=O)(=O)c1ccccc1NN
InChIInChI=1S/C11H19N3O3S/c1-9(7-8-17-2)14-18(15,16)11-6-4-3-5-10(11)13-12/h3-6,9,13-14H,7-8,12H2,1-2H3
InChIKeyTXLYNCCLYSMIRO-UHFFFAOYSA-N
XLogP0.68
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 50.68
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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Related Compounds

N-(4-methoxybutan-2-yl)-2-(methylamino)benzenesulfonamide
CID 64603296
3-hydrazinyl-N-(4-methoxybutan-2-yl)pyridine-2-sulfonamide
CID 103301657
2-(3-aminoprop-1-ynyl)-N-(4-methoxybutan-2-yl)benzenesulfonamide
CID 64605123
2-(ethylaminomethyl)-N-(4-methoxybutan-2-yl)benzenesulfonamide
CID 106067499
2-cyano-N-(4-methoxybutan-2-yl)pyridine-3-sulfonamide
CID 106545893
2-(2-methoxyethylamino)-N-propan-2-ylbenzenesulfonamide
CID 43383470
N-hexan-3-yl-2-hydrazinylbenzenesulfonamide
CID 62117288
4-hydrazinyl-N-(4-methoxybutan-2-yl)-3-nitrobenzenesulfonamide
CID 64605293
5-amino-2-bromo-N-(4-methoxybutan-2-yl)benzenesulfonamide
CID 65206608
5-amino-2-ethyl-N-(4-methoxybutan-2-yl)benzenesulfonamide
CID 64602405
2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide
CID 64605702
N-(4-methoxybutan-2-yl)-4-(methylamino)pyridine-3-sulfonamide
CID 64605130

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide?
The IUPAC name of 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide (CID 64605089) is 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide?
The canonical SMILES for 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide is COCCC(C)NS(=O)(=O)c1ccccc1NN.
What is the InChIKey of 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide?
The InChIKey is TXLYNCCLYSMIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S/c1-9(7-8-17-2)14-18(15,16)11-6-4-3-5-10(11)13-12/h3-6,9,13-14H,7-8,12H2,1-2H3.
What are the key properties of 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide?
2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide has a molecular weight of 273.36 g/mol, XLogP of 0.68, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide is sourced from PubChem (CID 64605089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).