2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide

C13H18N6O — CID 106218268

IUPAC2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide
SMILESCCc1cc(C(=O)NC(C)c2cn[nH]c2)cc(NN)n1
InChIInChI=1S/C13H18N6O/c1-3-11-4-9(5-12(18-11)19-14)13(20)17-8(2)10-6-15-16-7-10/h4-8H,3,14H2,1-2H3,(H,15,16)(H,17,20)(H,18,19)
InChIKeyIJSZSCYXRZIQIT-UHFFFAOYSA-N
MW274.33 g/mol
LogP1.14
Rot. Bonds5

About 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide

2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide (PubChem CID 106218268) has the molecular formula C13H18N6O and a molecular weight of 274.33 g/mol. Its IUPAC name is 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide
PubChem CID106218268
Molecular FormulaC13H18N6O
Molecular Weight274.33 g/mol
Exact Mass274.15
IUPAC Name2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide
SMILESCCc1cc(C(=O)NC(C)c2cn[nH]c2)cc(NN)n1
InChIInChI=1S/C13H18N6O/c1-3-11-4-9(5-12(18-11)19-14)13(20)17-8(2)10-6-15-16-7-10/h4-8H,3,14H2,1-2H3,(H,15,16)(H,17,20)(H,18,19)
InChIKeyIJSZSCYXRZIQIT-UHFFFAOYSA-N
XLogP1.14
TPSA108.72 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 51.14
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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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide (CID 106218268) is 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide is CCc1cc(C(=O)NC(C)c2cn[nH]c2)cc(NN)n1.
What is the InChIKey of 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide?
The InChIKey is IJSZSCYXRZIQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O/c1-3-11-4-9(5-12(18-11)19-14)13(20)17-8(2)10-6-15-16-7-10/h4-8H,3,14H2,1-2H3,(H,15,16)(H,17,20)(H,18,19).
What are the key properties of 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide?
2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide has a molecular weight of 274.33 g/mol, XLogP of 1.14, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-hydrazinyl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 106218268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).