5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide

C13H19N3O3 — CID 63860622

IUPAC5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)C(CC(C)C)NC(=O)c1cncc(O)c1
InChIInChI=1S/C13H19N3O3/c1-8(2)4-11(13(19)14-3)16-12(18)9-5-10(17)7-15-6-9/h5-8,11,17H,4H2,1-3H3,(H,14,19)(H,16,18)
InChIKeyHJNOOLCHTLGOEQ-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.68
Rot. Bonds5

About 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide

5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide (PubChem CID 63860622) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide
PubChem CID63860622
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide
SMILESCNC(=O)C(CC(C)C)NC(=O)c1cncc(O)c1
InChIInChI=1S/C13H19N3O3/c1-8(2)4-11(13(19)14-3)16-12(18)9-5-10(17)7-15-6-9/h5-8,11,17H,4H2,1-3H3,(H,14,19)(H,16,18)
InChIKeyHJNOOLCHTLGOEQ-UHFFFAOYSA-N
XLogP0.68
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide (CID 63860622) is 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide is CNC(=O)C(CC(C)C)NC(=O)c1cncc(O)c1.
What is the InChIKey of 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide?
The InChIKey is HJNOOLCHTLGOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-8(2)4-11(13(19)14-3)16-12(18)9-5-10(17)7-15-6-9/h5-8,11,17H,4H2,1-3H3,(H,14,19)(H,16,18).
What are the key properties of 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide?
5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 0.68, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 63860622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).