2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide

C13H19N3O3 — CID 141104525

IUPAC2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide
SMILESCCCC(C(N)=O)n1cccc(NC(=O)CC)c1=O
InChIInChI=1S/C13H19N3O3/c1-3-6-10(12(14)18)16-8-5-7-9(13(16)19)15-11(17)4-2/h5,7-8,10H,3-4,6H2,1-2H3,(H2,14,18)(H,15,17)
InChIKeyCIFSQNVZARGFEM-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.02
Rot. Bonds6

About 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide

2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide (PubChem CID 141104525) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide.

Molecular Properties

Compound Name2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide
PubChem CID141104525
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide
SMILESCCCC(C(N)=O)n1cccc(NC(=O)CC)c1=O
InChIInChI=1S/C13H19N3O3/c1-3-6-10(12(14)18)16-8-5-7-9(13(16)19)15-11(17)4-2/h5,7-8,10H,3-4,6H2,1-2H3,(H2,14,18)(H,15,17)
InChIKeyCIFSQNVZARGFEM-UHFFFAOYSA-N
XLogP1.02
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide?
The IUPAC name of 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide (CID 141104525) is 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide.
What is the SMILES notation for 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide?
The canonical SMILES for 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide is CCCC(C(N)=O)n1cccc(NC(=O)CC)c1=O.
What is the InChIKey of 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide?
The InChIKey is CIFSQNVZARGFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-3-6-10(12(14)18)16-8-5-7-9(13(16)19)15-11(17)4-2/h5,7-8,10H,3-4,6H2,1-2H3,(H2,14,18)(H,15,17).
What are the key properties of 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide?
2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide has a molecular weight of 265.31 g/mol, XLogP of 1.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-oxo-3-(propanoylamino)-1-pyridinyl]pentanamide is sourced from PubChem (CID 141104525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).