5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide

C10H16ClN5O3S — CID 106340809

IUPAC5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide
SMILESCS(=O)(=O)NCCCNC(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C10H16ClN5O3S/c1-20(18,19)15-4-2-3-13-10(17)7-5-8(11)9(16-12)14-6-7/h5-6,15H,2-4,12H2,1H3,(H,13,17)(H,14,16)
InChIKeyUGULISBTUJHVHS-UHFFFAOYSA-N
MW321.79 g/mol
LogP-0.31
Rot. Bonds7

About 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide

5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide (PubChem CID 106340809) has the molecular formula C10H16ClN5O3S and a molecular weight of 321.79 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide
PubChem CID106340809
Molecular FormulaC10H16ClN5O3S
Molecular Weight321.79 g/mol
Exact Mass321.07
IUPAC Name5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide
SMILESCS(=O)(=O)NCCCNC(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C10H16ClN5O3S/c1-20(18,19)15-4-2-3-13-10(17)7-5-8(11)9(16-12)14-6-7/h5-6,15H,2-4,12H2,1H3,(H,13,17)(H,14,16)
InChIKeyUGULISBTUJHVHS-UHFFFAOYSA-N
XLogP-0.31
TPSA126.21 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.79
LogP ≤ 5-0.31
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

5-chloro-6-hydrazinyl-N-(5-methylhexyl)pyridine-3-carboxamide
CID 113287874
5-chloro-6-hydrazinyl-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-carboxamide
CID 63861191
5-chloro-6-hydrazinyl-N-[3-(2-methylpropoxy)propyl]pyridine-3-carboxamide
CID 114098385
5-amino-2-chloro-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide
CID 106332653
5-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyrazine-2-carboxamide
CID 106340836
5-chloro-6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-carboxamide
CID 62248435
5-chloro-6-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-3-carboxamide
CID 80686009
5-chloro-6-(methylamino)-N-(3-methylsulfanylpropyl)pyridine-3-carboxamide
CID 63963372
N-(5-amino-5-oxopentyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 106241047
5-chloro-6-hydrazinyl-N-(3-methylbutan-2-yl)pyridine-3-carboxamide
CID 62243839
5-chloro-6-hydrazinyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-3-carboxamide
CID 62840708
5-chloro-6-hydrazinyl-N-pentan-3-ylpyridine-3-carboxamide
CID 62247358

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide (CID 106340809) is 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide is CS(=O)(=O)NCCCNC(=O)c1cnc(NN)c(Cl)c1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide?
The InChIKey is UGULISBTUJHVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN5O3S/c1-20(18,19)15-4-2-3-13-10(17)7-5-8(11)9(16-12)14-6-7/h5-6,15H,2-4,12H2,1H3,(H,13,17)(H,14,16).
What are the key properties of 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide?
5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide has a molecular weight of 321.79 g/mol, XLogP of -0.31, 7 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 106340809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).