5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide

C9H16N6O3S — CID 106340836

IUPAC5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide
SMILESCS(=O)(=O)NCCCNC(=O)c1cnc(NN)cn1
InChIInChI=1S/C9H16N6O3S/c1-19(17,18)14-4-2-3-11-9(16)7-5-13-8(15-10)6-12-7/h5-6,14H,2-4,10H2,1H3,(H,11,16)(H,13,15)
InChIKeyJAAIUGJIYSLWGF-UHFFFAOYSA-N
MW288.33 g/mol
LogP-1.57
Rot. Bonds7

About 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide

5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide (PubChem CID 106340836) has the molecular formula C9H16N6O3S and a molecular weight of 288.33 g/mol. Its IUPAC name is 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide
PubChem CID106340836
Molecular FormulaC9H16N6O3S
Molecular Weight288.33 g/mol
Exact Mass288.10
IUPAC Name5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide
SMILESCS(=O)(=O)NCCCNC(=O)c1cnc(NN)cn1
InChIInChI=1S/C9H16N6O3S/c1-19(17,18)14-4-2-3-11-9(16)7-5-13-8(15-10)6-12-7/h5-6,14H,2-4,10H2,1H3,(H,11,16)(H,13,15)
InChIKeyJAAIUGJIYSLWGF-UHFFFAOYSA-N
XLogP-1.57
TPSA139.10 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 5-1.57
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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

6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide
CID 106340799
5-hydrazinyl-N-(4-methylsulfanylbutyl)pyrazine-2-carboxamide
CID 107378653
N-(2-fluoroethyl)-5-hydrazinylpyrazine-2-carboxamide
CID 130504959
5-hydrazinyl-N-(3-phenylpropyl)pyrazine-2-carboxamide
CID 107377524
N-[3-(methanesulfonamido)propyl]-5-(methylamino)pyridine-2-carboxamide
CID 106342397
5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide
CID 106340809
6-amino-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide
CID 114175964
N-(2,2-dimethylpropyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107377627
5-(propylamino)-N-(3-sulfamoylpropyl)pyrazine-2-carboxamide
CID 107374837
5-hydrazinyl-N-(2-methyl-2-methylsulfanylpropyl)pyrazine-2-carboxamide
CID 107378643
5-hydrazinyl-N-[2-(1H-imidazol-2-yl)ethyl]pyrazine-2-carboxamide
CID 107378673
5-hydrazinyl-N-(2-imidazol-1-ylethyl)pyrazine-2-carboxamide
CID 107378052

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide (CID 106340836) is 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide is CS(=O)(=O)NCCCNC(=O)c1cnc(NN)cn1.
What is the InChIKey of 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide?
The InChIKey is JAAIUGJIYSLWGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6O3S/c1-19(17,18)14-4-2-3-11-9(16)7-5-13-8(15-10)6-12-7/h5-6,14H,2-4,10H2,1H3,(H,11,16)(H,13,15).
What are the key properties of 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide?
5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide has a molecular weight of 288.33 g/mol, XLogP of -1.57, 7 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide is sourced from PubChem (CID 106340836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).