N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide

C15H26N2O2 — CID 79552796

IUPACN-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
SMILESCCNC(=O)CN1CCCCC1C1CCCCC1=O
InChIInChI=1S/C15H26N2O2/c1-2-16-15(19)11-17-10-6-5-8-13(17)12-7-3-4-9-14(12)18/h12-13H,2-11H2,1H3,(H,16,19)
InChIKeyKPYUYQCYCMIQRC-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.74
Rot. Bonds4

About N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide

N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide (PubChem CID 79552796) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
PubChem CID79552796
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
SMILESCCNC(=O)CN1CCCCC1C1CCCCC1=O
InChIInChI=1S/C15H26N2O2/c1-2-16-15(19)11-17-10-6-5-8-13(17)12-7-3-4-9-14(12)18/h12-13H,2-11H2,1H3,(H,16,19)
InChIKeyKPYUYQCYCMIQRC-UHFFFAOYSA-N
XLogP1.74
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
The IUPAC name of N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide (CID 79552796) is N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide is CCNC(=O)CN1CCCCC1C1CCCCC1=O.
What is the InChIKey of N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
The InChIKey is KPYUYQCYCMIQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-2-16-15(19)11-17-10-6-5-8-13(17)12-7-3-4-9-14(12)18/h12-13H,2-11H2,1H3,(H,16,19).
What are the key properties of N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide has a molecular weight of 266.38 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 79552796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).