2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide

C12H14N4O4 — CID 134716946

IUPAC2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
SMILESCc1noc(CNC(=O)Cn2c(C)cc(O)cc2=O)n1
InChIInChI=1S/C12H14N4O4/c1-7-3-9(17)4-12(19)16(7)6-10(18)13-5-11-14-8(2)15-20-11/h3-4,17H,5-6H2,1-2H3,(H,13,18)
InChIKeySWTVIQUHAREGBH-UHFFFAOYSA-N
MW278.27 g/mol
LogP-0.13
Rot. Bonds4

About 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide

2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide (PubChem CID 134716946) has the molecular formula C12H14N4O4 and a molecular weight of 278.27 g/mol. Its IUPAC name is 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
PubChem CID134716946
Molecular FormulaC12H14N4O4
Molecular Weight278.27 g/mol
Exact Mass278.10
IUPAC Name2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
SMILESCc1noc(CNC(=O)Cn2c(C)cc(O)cc2=O)n1
InChIInChI=1S/C12H14N4O4/c1-7-3-9(17)4-12(19)16(7)6-10(18)13-5-11-14-8(2)15-20-11/h3-4,17H,5-6H2,1-2H3,(H,13,18)
InChIKeySWTVIQUHAREGBH-UHFFFAOYSA-N
XLogP-0.13
TPSA110.25 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
The IUPAC name of 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide (CID 134716946) is 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
The canonical SMILES for 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide is Cc1noc(CNC(=O)Cn2c(C)cc(O)cc2=O)n1.
What is the InChIKey of 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
The InChIKey is SWTVIQUHAREGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O4/c1-7-3-9(17)4-12(19)16(7)6-10(18)13-5-11-14-8(2)15-20-11/h3-4,17H,5-6H2,1-2H3,(H,13,18).
What are the key properties of 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide has a molecular weight of 278.27 g/mol, XLogP of -0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide is sourced from PubChem (CID 134716946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).