2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide

C13H23N3O3 — CID 62050745

IUPAC2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide
SMILESCCCCN(CC(N)=O)CC(=O)N1CCC(=O)CC1
InChIInChI=1S/C13H23N3O3/c1-2-3-6-15(9-12(14)18)10-13(19)16-7-4-11(17)5-8-16/h2-10H2,1H3,(H2,14,18)
InChIKeyQWBJQRFJDMEGPT-UHFFFAOYSA-N
MW269.34 g/mol
LogP-0.23
Rot. Bonds7

About 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide

2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide (PubChem CID 62050745) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide.

Molecular Properties

Compound Name2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide
PubChem CID62050745
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC Name2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide
SMILESCCCCN(CC(N)=O)CC(=O)N1CCC(=O)CC1
InChIInChI=1S/C13H23N3O3/c1-2-3-6-15(9-12(14)18)10-13(19)16-7-4-11(17)5-8-16/h2-10H2,1H3,(H2,14,18)
InChIKeyQWBJQRFJDMEGPT-UHFFFAOYSA-N
XLogP-0.23
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide?
The IUPAC name of 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide (CID 62050745) is 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide.
What is the SMILES notation for 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide?
The canonical SMILES for 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide is CCCCN(CC(N)=O)CC(=O)N1CCC(=O)CC1.
What is the InChIKey of 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide?
The InChIKey is QWBJQRFJDMEGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c1-2-3-6-15(9-12(14)18)10-13(19)16-7-4-11(17)5-8-16/h2-10H2,1H3,(H2,14,18).
What are the key properties of 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide?
2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide has a molecular weight of 269.34 g/mol, XLogP of -0.23, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]amino]acetamide is sourced from PubChem (CID 62050745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).