N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide

C10H10N4O3 — CID 113257757

IUPACN-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESO=C(NCCc1ncno1)c1cc[nH]c(=O)c1
InChIInChI=1S/C10H10N4O3/c15-8-5-7(1-3-11-8)10(16)12-4-2-9-13-6-14-17-9/h1,3,5-6H,2,4H2,(H,11,15)(H,12,16)
InChIKeyYFRKJXPSUFZLCJ-UHFFFAOYSA-N
MW234.22 g/mol
LogP-0.27
Rot. Bonds4

About N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide

N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 113257757) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide
PubChem CID113257757
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC NameN-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESO=C(NCCc1ncno1)c1cc[nH]c(=O)c1
InChIInChI=1S/C10H10N4O3/c15-8-5-7(1-3-11-8)10(16)12-4-2-9-13-6-14-17-9/h1,3,5-6H,2,4H2,(H,11,15)(H,12,16)
InChIKeyYFRKJXPSUFZLCJ-UHFFFAOYSA-N
XLogP-0.27
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide (CID 113257757) is N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide is O=C(NCCc1ncno1)c1cc[nH]c(=O)c1.
What is the InChIKey of N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is YFRKJXPSUFZLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c15-8-5-7(1-3-11-8)10(16)12-4-2-9-13-6-14-17-9/h1,3,5-6H,2,4H2,(H,11,15)(H,12,16).
What are the key properties of N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide?
N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 234.22 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 113257757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).