5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide

C10H13N7O — CID 104643051

IUPAC5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide
SMILESNNc1ccc(C(=O)NCCn2ccnn2)nc1
InChIInChI=1S/C10H13N7O/c11-15-8-1-2-9(13-7-8)10(18)12-3-5-17-6-4-14-16-17/h1-2,4,6-7,15H,3,5,11H2,(H,12,18)
InChIKeyVIBMIGPMNIHAKZ-UHFFFAOYSA-N
MW247.26 g/mol
LogP-0.61
Rot. Bonds5

About 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide

5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide (PubChem CID 104643051) has the molecular formula C10H13N7O and a molecular weight of 247.26 g/mol. Its IUPAC name is 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide
PubChem CID104643051
Molecular FormulaC10H13N7O
Molecular Weight247.26 g/mol
Exact Mass247.12
IUPAC Name5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide
SMILESNNc1ccc(C(=O)NCCn2ccnn2)nc1
InChIInChI=1S/C10H13N7O/c11-15-8-1-2-9(13-7-8)10(18)12-3-5-17-6-4-14-16-17/h1-2,4,6-7,15H,3,5,11H2,(H,12,18)
InChIKeyVIBMIGPMNIHAKZ-UHFFFAOYSA-N
XLogP-0.61
TPSA110.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 5-0.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide (CID 104643051) is 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide is NNc1ccc(C(=O)NCCn2ccnn2)nc1.
What is the InChIKey of 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is VIBMIGPMNIHAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N7O/c11-15-8-1-2-9(13-7-8)10(18)12-3-5-17-6-4-14-16-17/h1-2,4,6-7,15H,3,5,11H2,(H,12,18).
What are the key properties of 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide?
5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 247.26 g/mol, XLogP of -0.61, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 104643051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).