N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide

C11H16N2O3 — CID 135840410

IUPACN,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1c(C)cc(=O)[nH]c1O
InChIInChI=1S/C11H16N2O3/c1-4-13(5-2)11(16)9-7(3)6-8(14)12-10(9)15/h6H,4-5H2,1-3H3,(H2,12,14,15)
InChIKeyNGVKOPIMITXCDL-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.87
Rot. Bonds3

About N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide

N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 135840410) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
PubChem CID135840410
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC NameN,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1c(C)cc(=O)[nH]c1O
InChIInChI=1S/C11H16N2O3/c1-4-13(5-2)11(16)9-7(3)6-8(14)12-10(9)15/h6H,4-5H2,1-3H3,(H2,12,14,15)
InChIKeyNGVKOPIMITXCDL-UHFFFAOYSA-N
XLogP0.87
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide (CID 135840410) is N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide is CCN(CC)C(=O)c1c(C)cc(=O)[nH]c1O.
What is the InChIKey of N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is NGVKOPIMITXCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-4-13(5-2)11(16)9-7(3)6-8(14)12-10(9)15/h6H,4-5H2,1-3H3,(H2,12,14,15).
What are the key properties of N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 135840410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).