2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide

C11H16N2O4 — CID 23338643

IUPAC2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide
SMILESCOCCCn1c(O)c(C(N)=O)c(C)cc1=O
InChIInChI=1S/C11H16N2O4/c1-7-6-8(14)13(4-3-5-17-2)11(16)9(7)10(12)15/h6,16H,3-5H2,1-2H3,(H2,12,15)
InChIKeyFODKIJALNUPCDR-UHFFFAOYSA-N
MW240.26 g/mol
LogP-0.00
Rot. Bonds5

About 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide

2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide (PubChem CID 23338643) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide
PubChem CID23338643
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC Name2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide
SMILESCOCCCn1c(O)c(C(N)=O)c(C)cc1=O
InChIInChI=1S/C11H16N2O4/c1-7-6-8(14)13(4-3-5-17-2)11(16)9(7)10(12)15/h6,16H,3-5H2,1-2H3,(H2,12,15)
InChIKeyFODKIJALNUPCDR-UHFFFAOYSA-N
XLogP-0.00
TPSA94.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide (CID 23338643) is 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide is COCCCn1c(O)c(C(N)=O)c(C)cc1=O.
What is the InChIKey of 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is FODKIJALNUPCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c1-7-6-8(14)13(4-3-5-17-2)11(16)9(7)10(12)15/h6,16H,3-5H2,1-2H3,(H2,12,15).
What are the key properties of 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide?
2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 240.26 g/mol, XLogP of -0.00, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 23338643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).