N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide

C11H16N2O3 — CID 20541698

IUPACN-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide
SMILESCC(=O)NCCn1c(O)c(C)c(C)cc1=O
InChIInChI=1S/C11H16N2O3/c1-7-6-10(15)13(11(16)8(7)2)5-4-12-9(3)14/h6,16H,4-5H2,1-3H3,(H,12,14)
InChIKeyDGIRFEWSDBLORN-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.31
Rot. Bonds3

About N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide

N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide (PubChem CID 20541698) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide
PubChem CID20541698
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC NameN-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide
SMILESCC(=O)NCCn1c(O)c(C)c(C)cc1=O
InChIInChI=1S/C11H16N2O3/c1-7-6-10(15)13(11(16)8(7)2)5-4-12-9(3)14/h6,16H,4-5H2,1-3H3,(H,12,14)
InChIKeyDGIRFEWSDBLORN-UHFFFAOYSA-N
XLogP0.31
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide?
The IUPAC name of N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide (CID 20541698) is N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide.
What is the SMILES notation for N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide?
The canonical SMILES for N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide is CC(=O)NCCn1c(O)c(C)c(C)cc1=O.
What is the InChIKey of N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide?
The InChIKey is DGIRFEWSDBLORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-7-6-10(15)13(11(16)8(7)2)5-4-12-9(3)14/h6,16H,4-5H2,1-3H3,(H,12,14).
What are the key properties of N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide?
N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide has a molecular weight of 224.26 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxy-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide is sourced from PubChem (CID 20541698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).