1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide

C11H12N4O3 — CID 103744059

IUPAC1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCCc2ncno2)cc1=O
InChIInChI=1S/C11H12N4O3/c1-15-5-3-8(6-10(15)16)11(17)12-4-2-9-13-7-14-18-9/h3,5-7H,2,4H2,1H3,(H,12,17)
InChIKeyNDJHIHOCTZSYRO-UHFFFAOYSA-N
MW248.24 g/mol
LogP-0.26
Rot. Bonds4

About 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide

1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide (PubChem CID 103744059) has the molecular formula C11H12N4O3 and a molecular weight of 248.24 g/mol. Its IUPAC name is 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide
PubChem CID103744059
Molecular FormulaC11H12N4O3
Molecular Weight248.24 g/mol
Exact Mass248.09
IUPAC Name1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCCc2ncno2)cc1=O
InChIInChI=1S/C11H12N4O3/c1-15-5-3-8(6-10(15)16)11(17)12-4-2-9-13-7-14-18-9/h3,5-7H,2,4H2,1H3,(H,12,17)
InChIKeyNDJHIHOCTZSYRO-UHFFFAOYSA-N
XLogP-0.26
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-3-[2-oxo-4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyridin-1-yl]propanamide
CID 145423108
5-[3-(3-methyl-1,2,4-oxadiazol-5-yl)azetidine-1-carbonyl]-1H-pyridin-2-one
CID 49744741
3-[3-(3-methyl-1,2,4-oxadiazol-5-yl)azetidine-1-carbonyl]-1H-pyridin-2-one
CID 49744742
2-hydroxy-N-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)ethyl]-N-methylnicotinamide
CID 90647755
6-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-4-oxo-1H-pyridine-3-carboxamide
CID 103744015
(E)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]but-2-enamide
CID 103744070
1,3-Dimethyl-5-[[2-(1,2,4-oxadiazol-5-yl)ethylamino]methyl]pyrimidine-2,4-dione
CID 103744522
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103763084
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103765295
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103765575
4-[3-(2-Aminoethyl)-1,2,4-oxadiazol-5-yl]-1-methylpyridin-2-one
CID 104879838
1-Methyl-4-[3-[2-(methylamino)ethyl]-1,2,4-oxadiazol-5-yl]pyridin-2-one
CID 104880108

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide?
The IUPAC name of 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide (CID 103744059) is 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide?
The canonical SMILES for 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)NCCc2ncno2)cc1=O.
What is the InChIKey of 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide?
The InChIKey is NDJHIHOCTZSYRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3/c1-15-5-3-8(6-10(15)16)11(17)12-4-2-9-13-7-14-18-9/h3,5-7H,2,4H2,1H3,(H,12,17).
What are the key properties of 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide?
1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide has a molecular weight of 248.24 g/mol, XLogP of -0.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103744059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).