1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide

C14H14N2O3 — CID 3620214

IUPAC1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
SMILESCc1cc(=O)n(Cc2ccccc2)c(O)c1C(N)=O
InChIInChI=1S/C14H14N2O3/c1-9-7-11(17)16(14(19)12(9)13(15)18)8-10-5-3-2-4-6-10/h2-7,19H,8H2,1H3,(H2,15,18)
InChIKeyFPRHBAUXPLGRGB-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.01
Rot. Bonds3

About 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide

1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide (PubChem CID 3620214) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
PubChem CID3620214
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
SMILESCc1cc(=O)n(Cc2ccccc2)c(O)c1C(N)=O
InChIInChI=1S/C14H14N2O3/c1-9-7-11(17)16(14(19)12(9)13(15)18)8-10-5-3-2-4-6-10/h2-7,19H,8H2,1H3,(H2,15,18)
InChIKeyFPRHBAUXPLGRGB-UHFFFAOYSA-N
XLogP1.01
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide (CID 3620214) is 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide is Cc1cc(=O)n(Cc2ccccc2)c(O)c1C(N)=O.
What is the InChIKey of 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is FPRHBAUXPLGRGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-9-7-11(17)16(14(19)12(9)13(15)18)8-10-5-3-2-4-6-10/h2-7,19H,8H2,1H3,(H2,15,18).
What are the key properties of 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 3620214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).