4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide

C11H16N2O3 — CID 10609176

IUPAC4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide
SMILESCNC(=O)CCCn1ccc(=O)c(O)c1C
InChIInChI=1S/C11H16N2O3/c1-8-11(16)9(14)5-7-13(8)6-3-4-10(15)12-2/h5,7,16H,3-4,6H2,1-2H3,(H,12,15)
InChIKeyDYEKQARJLWAPSG-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.39
Rot. Bonds4

About 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide

4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide (PubChem CID 10609176) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide.

Molecular Properties

Compound Name4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide
PubChem CID10609176
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide
SMILESCNC(=O)CCCn1ccc(=O)c(O)c1C
InChIInChI=1S/C11H16N2O3/c1-8-11(16)9(14)5-7-13(8)6-3-4-10(15)12-2/h5,7,16H,3-4,6H2,1-2H3,(H,12,15)
InChIKeyDYEKQARJLWAPSG-UHFFFAOYSA-N
XLogP0.39
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide?
The IUPAC name of 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide (CID 10609176) is 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide.
What is the SMILES notation for 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide?
The canonical SMILES for 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide is CNC(=O)CCCn1ccc(=O)c(O)c1C.
What is the InChIKey of 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide?
The InChIKey is DYEKQARJLWAPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-8-11(16)9(14)5-7-13(8)6-3-4-10(15)12-2/h5,7,16H,3-4,6H2,1-2H3,(H,12,15).
What are the key properties of 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide?
4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide has a molecular weight of 224.26 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide is sourced from PubChem (CID 10609176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).