3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide

C9H14FN5O3S — CID 105387918

IUPAC3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide
SMILESNNc1nccc(C(=O)NCCCS(N)(=O)=O)c1F
InChIInChI=1S/C9H14FN5O3S/c10-7-6(2-4-13-8(7)15-11)9(16)14-3-1-5-19(12,17)18/h2,4H,1,3,5,11H2,(H,13,15)(H,14,16)(H2,12,17,18)
InChIKeyGMELMASUGALMCR-UHFFFAOYSA-N
MW291.31 g/mol
LogP-1.09
Rot. Bonds6

About 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide

3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide (PubChem CID 105387918) has the molecular formula C9H14FN5O3S and a molecular weight of 291.31 g/mol. Its IUPAC name is 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide
PubChem CID105387918
Molecular FormulaC9H14FN5O3S
Molecular Weight291.31 g/mol
Exact Mass291.08
IUPAC Name3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide
SMILESNNc1nccc(C(=O)NCCCS(N)(=O)=O)c1F
InChIInChI=1S/C9H14FN5O3S/c10-7-6(2-4-13-8(7)15-11)9(16)14-3-1-5-19(12,17)18/h2,4H,1,3,5,11H2,(H,13,15)(H,14,16)(H2,12,17,18)
InChIKeyGMELMASUGALMCR-UHFFFAOYSA-N
XLogP-1.09
TPSA140.20 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 5-1.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[2-(ethylsulfamoyl)ethyl]-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 106340899
2,3-difluoro-N-(2-sulfamoylethyl)pyridine-4-carboxamide
CID 105380386
N-(3-ethoxypropyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105388114
N-(3-cyclopentylpropyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 106012747
N-[2-(diethylamino)ethyl]-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105387949
N-[2-(2-amino-2-oxoethoxy)ethyl]-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 106241316
N-[(2-bromophenyl)methyl]-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105388066
2-amino-3-fluoro-N-(3-methylsulfonylpropyl)pyridine-4-carboxamide
CID 105385347
3-fluoro-2-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-4-carboxamide
CID 105387848
3-fluoro-N-[2-(3-fluorophenyl)ethyl]-2-hydrazinylpyridine-4-carboxamide
CID 105388258
3-fluoro-2-hydrazinyl-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-4-carboxamide
CID 105388504
3-fluoro-2-hydrazinyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-4-carboxamide
CID 106423139

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide (CID 105387918) is 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide is NNc1nccc(C(=O)NCCCS(N)(=O)=O)c1F.
What is the InChIKey of 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide?
The InChIKey is GMELMASUGALMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN5O3S/c10-7-6(2-4-13-8(7)15-11)9(16)14-3-1-5-19(12,17)18/h2,4H,1,3,5,11H2,(H,13,15)(H,14,16)(H2,12,17,18).
What are the key properties of 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide?
3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide has a molecular weight of 291.31 g/mol, XLogP of -1.09, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-hydrazinyl-N-(3-sulfamoylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 105387918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).