2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide

C14H26N2O2 — CID 114509023

IUPAC2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)CN1CCC(=O)C(CC)C1
InChIInChI=1S/C14H26N2O2/c1-4-11-9-16(8-7-13(11)17)10-14(18)15-12(5-2)6-3/h11-12H,4-10H2,1-3H3,(H,15,18)
InChIKeyXLMKGYGQVPPUJX-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.59
Rot. Bonds6

About 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide

2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide (PubChem CID 114509023) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide.

Molecular Properties

Compound Name2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide
PubChem CID114509023
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)CN1CCC(=O)C(CC)C1
InChIInChI=1S/C14H26N2O2/c1-4-11-9-16(8-7-13(11)17)10-14(18)15-12(5-2)6-3/h11-12H,4-10H2,1-3H3,(H,15,18)
InChIKeyXLMKGYGQVPPUJX-UHFFFAOYSA-N
XLogP1.59
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-2-(3-ethyl-4-oxopiperidin-1-yl)acetamide
CID 114508966
methyl 2-(3-ethyl-4-oxopiperidin-1-yl)acetate
CID 114509007
N-butan-2-yl-2-(3-methyl-4-oxopiperidin-1-yl)acetamide
CID 114500179
N-ethyl-2-(3-ethyl-4-oxopiperidin-1-yl)-N-methylacetamide
CID 114508729
3-ethyl-1-(2-oxopentyl)piperidin-4-one
CID 114509766
2-[(3S)-3-aminopyrrolidin-1-yl]-N-pentan-3-ylacetamide
CID 81492736
3-ethyl-1-(2-hydroxybutyl)piperidin-4-one
CID 114508808
2-(4-aminopiperidin-1-yl)-N-pentan-3-ylacetamide
CID 61486865
butyl 2-(3-ethyl-4-oxopiperidin-1-yl)acetate
CID 114508947
3-ethyl-1-(3-hydroxy-3-methylbutyl)piperidin-4-one
CID 114508829
2-(4-acetylpiperidin-1-yl)-N-pentan-3-ylacetamide
CID 63846330
3-ethyl-1-(2-oxo-3-phenylpropyl)piperidin-4-one
CID 114509764

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide?
The IUPAC name of 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide (CID 114509023) is 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide.
What is the SMILES notation for 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide?
The canonical SMILES for 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide is CCC(CC)NC(=O)CN1CCC(=O)C(CC)C1.
What is the InChIKey of 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide?
The InChIKey is XLMKGYGQVPPUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-4-11-9-16(8-7-13(11)17)10-14(18)15-12(5-2)6-3/h11-12H,4-10H2,1-3H3,(H,15,18).
What are the key properties of 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide?
2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide has a molecular weight of 254.37 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-4-oxopiperidin-1-yl)-N-pentan-3-ylacetamide is sourced from PubChem (CID 114509023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).