3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide

C10H15FN4O3S — CID 106340868

IUPAC3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide
SMILESCNS(=O)(=O)CCNC(=O)c1cccc(F)c1NN
InChIInChI=1S/C10H15FN4O3S/c1-13-19(17,18)6-5-14-10(16)7-3-2-4-8(11)9(7)15-12/h2-4,13,15H,5-6,12H2,1H3,(H,14,16)
InChIKeyMJUPEXDDARQXND-UHFFFAOYSA-N
MW290.32 g/mol
LogP-0.61
Rot. Bonds6

About 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide

3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide (PubChem CID 106340868) has the molecular formula C10H15FN4O3S and a molecular weight of 290.32 g/mol. Its IUPAC name is 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide.

Molecular Properties

Compound Name3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide
PubChem CID106340868
Molecular FormulaC10H15FN4O3S
Molecular Weight290.32 g/mol
Exact Mass290.08
IUPAC Name3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide
SMILESCNS(=O)(=O)CCNC(=O)c1cccc(F)c1NN
InChIInChI=1S/C10H15FN4O3S/c1-13-19(17,18)6-5-14-10(16)7-3-2-4-8(11)9(7)15-12/h2-4,13,15H,5-6,12H2,1H3,(H,14,16)
InChIKeyMJUPEXDDARQXND-UHFFFAOYSA-N
XLogP-0.61
TPSA113.32 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 5-0.61
H-Bond Donors ≤ 54
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

3-fluoro-2-hydrazinyl-N-[3-(methanesulfonamido)propyl]benzamide
CID 114175770
3,5-difluoro-4-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 106340860
N-[2-(dimethylcarbamoylamino)ethyl]-3-fluoro-2-hydrazinylbenzamide
CID 83114769
2-(ethylamino)-N-[2-(ethylsulfamoyl)ethyl]-3-fluorobenzamide
CID 106342576
3-fluoro-2-[2-(methylsulfamoyl)ethylamino]benzoic acid
CID 114175610
2-fluoro-N-[2-(methylsulfamoyl)ethyl]-3-(trifluoromethyl)benzamide
CID 102685069
2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 114175674
3-fluoro-2-hydrazinyl-N-[3-[methyl(propan-2-yl)amino]propyl]benzamide
CID 106040313
2-iodo-3-methyl-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 102685129
3-fluoro-N-[(2-fluorophenyl)methyl]-2-hydrazinylbenzamide
CID 62660803
N-(cyclopropylmethyl)-3-fluoro-2-hydrazinylbenzamide
CID 62660969
3-fluoro-2-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)benzamide
CID 79865248

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide?
The IUPAC name of 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide (CID 106340868) is 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide.
What is the SMILES notation for 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide?
The canonical SMILES for 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide is CNS(=O)(=O)CCNC(=O)c1cccc(F)c1NN.
What is the InChIKey of 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide?
The InChIKey is MJUPEXDDARQXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN4O3S/c1-13-19(17,18)6-5-14-10(16)7-3-2-4-8(11)9(7)15-12/h2-4,13,15H,5-6,12H2,1H3,(H,14,16).
What are the key properties of 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide?
3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide has a molecular weight of 290.32 g/mol, XLogP of -0.61, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide is sourced from PubChem (CID 106340868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).