2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide

C14H17N3O3S — CID 43454817

IUPAC2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
SMILESCOc1ccccc1CNS(=O)(=O)c1ccccc1NN
InChIInChI=1S/C14H17N3O3S/c1-20-13-8-4-2-6-11(13)10-16-21(18,19)14-9-5-3-7-12(14)17-15/h2-9,16-17H,10,15H2,1H3
InChIKeyUPWJSEDZYAPFHR-UHFFFAOYSA-N
MW307.38 g/mol
LogP1.46
Rot. Bonds6

About 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide

2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide (PubChem CID 43454817) has the molecular formula C14H17N3O3S and a molecular weight of 307.38 g/mol. Its IUPAC name is 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
PubChem CID43454817
Molecular FormulaC14H17N3O3S
Molecular Weight307.38 g/mol
Exact Mass307.10
IUPAC Name2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
SMILESCOc1ccccc1CNS(=O)(=O)c1ccccc1NN
InChIInChI=1S/C14H17N3O3S/c1-20-13-8-4-2-6-11(13)10-16-21(18,19)14-9-5-3-7-12(14)17-15/h2-9,16-17H,10,15H2,1H3
InChIKeyUPWJSEDZYAPFHR-UHFFFAOYSA-N
XLogP1.46
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 51.46
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

2-amino-N-[(2-methoxyphenyl)methyl]pyridine-3-sulfonamide
CID 62164569
1-methoxy-2-[(sulfamoylamino)methyl]benzene
CID 21041220
2,4-dimethoxy-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
CID 6468216
2-chloro-N-[(2-methoxyphenyl)methyl]pyridine-3-sulfonamide
CID 43414928
N-benzyl-2-hydrazinylbenzenesulfonamide
CID 43454886
5-amino-2-bromo-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
CID 65202045
5-ethyl-2-methoxy-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
CID 110757861
4-chloro-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzenesulfonamide
CID 19680723
N-[(2-methoxyphenyl)methyl]-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 7244636
3-amino-1-ethyl-N-[(2-methoxyphenyl)methyl]pyrazole-4-sulfonamide
CID 60808107
3-[(2-methoxyphenyl)methylamino]-N,2-dimethylbenzenesulfonamide
CID 167917867
N-[(2-methoxyphenyl)methyl]isoquinoline-5-sulfonamide;hydrochloride
CID 16846036

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
The IUPAC name of 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide (CID 43454817) is 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
The canonical SMILES for 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide is COc1ccccc1CNS(=O)(=O)c1ccccc1NN.
What is the InChIKey of 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
The InChIKey is UPWJSEDZYAPFHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S/c1-20-13-8-4-2-6-11(13)10-16-21(18,19)14-9-5-3-7-12(14)17-15/h2-9,16-17H,10,15H2,1H3.
What are the key properties of 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide has a molecular weight of 307.38 g/mol, XLogP of 1.46, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide is sourced from PubChem (CID 43454817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).