2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide

C10H17N3O2S2 — CID 112661404

IUPAC2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide
SMILESCSCCN(C)S(=O)(=O)c1ccccc1NN
InChIInChI=1S/C10H17N3O2S2/c1-13(7-8-16-2)17(14,15)10-6-4-3-5-9(10)12-11/h3-6,12H,7-8,11H2,1-2H3
InChIKeyPYDNONPTVGTRFG-UHFFFAOYSA-N
MW275.40 g/mol
LogP0.96
Rot. Bonds6

About 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide

2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide (PubChem CID 112661404) has the molecular formula C10H17N3O2S2 and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide
PubChem CID112661404
Molecular FormulaC10H17N3O2S2
Molecular Weight275.40 g/mol
Exact Mass275.08
IUPAC Name2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide
SMILESCSCCN(C)S(=O)(=O)c1ccccc1NN
InChIInChI=1S/C10H17N3O2S2/c1-13(7-8-16-2)17(14,15)10-6-4-3-5-9(10)12-11/h3-6,12H,7-8,11H2,1-2H3
InChIKeyPYDNONPTVGTRFG-UHFFFAOYSA-N
XLogP0.96
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 50.96
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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Related Compounds

2-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)benzenesulfonamide
CID 60890269
2-(chloromethyl)-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide
CID 112667071
2-amino-3-fluoro-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide
CID 112656609
N-(cyclopentylmethyl)-2-hydrazinyl-N-methylbenzenesulfonamide
CID 63656151
2-chloro-N-methyl-N-(2-methylsulfanylethyl)pyridine-3-sulfonamide
CID 112698550
4-amino-2-cyano-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide
CID 112656535
2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzamide
CID 112664377
3-amino-N-methyl-N-(2-methylsulfanylethyl)-2-nitrobenzenesulfonamide
CID 112675350
2-hydrazinyl-N,N-bis(2-methylpropyl)benzenesulfonamide
CID 61377131
N-methyl-N-(2-methylsulfanylethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306973
4-amino-N,2-dimethyl-N-(2-methylsulfanylethyl)benzenesulfonamide
CID 112656554
2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 115986127

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide?
The IUPAC name of 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide (CID 112661404) is 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide?
The canonical SMILES for 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide is CSCCN(C)S(=O)(=O)c1ccccc1NN.
What is the InChIKey of 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide?
The InChIKey is PYDNONPTVGTRFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S2/c1-13(7-8-16-2)17(14,15)10-6-4-3-5-9(10)12-11/h3-6,12H,7-8,11H2,1-2H3.
What are the key properties of 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide?
2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide has a molecular weight of 275.40 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-methyl-N-(2-methylsulfanylethyl)benzenesulfonamide is sourced from PubChem (CID 112661404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).