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

C13H22N2O2 — CID 79552802

IUPAC2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCCCC1C1CCCCC1=O
InChIInChI=1S/C13H22N2O2/c14-13(17)9-15-8-4-3-6-11(15)10-5-1-2-7-12(10)16/h10-11H,1-9H2,(H2,14,17)
InChIKeyWIZUVNKINCRPIK-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.09
Rot. Bonds3

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

2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide (PubChem CID 79552802) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
PubChem CID79552802
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCCCC1C1CCCCC1=O
InChIInChI=1S/C13H22N2O2/c14-13(17)9-15-8-4-3-6-11(15)10-5-1-2-7-12(10)16/h10-11H,1-9H2,(H2,14,17)
InChIKeyWIZUVNKINCRPIK-UHFFFAOYSA-N
XLogP1.09
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
CID 79552796
N-methyl-2-[2-(2-oxocyclopentyl)piperidin-1-yl]acetamide
CID 79544652
N-ethyl-N-methyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
CID 79553575
2-(2-cyclohexylpiperidin-1-yl)acetamide
CID 67699476
N-tert-butyl-2-[2-(2-oxocyclohexyl)pyrrolidin-1-yl]acetamide
CID 79548763
2-[1-(cyclobutylmethyl)piperidin-2-yl]cyclohexan-1-one
CID 79553179
2-[1-(2-hydroxypropyl)piperidin-2-yl]cyclohexan-1-one
CID 79553644
2-[2-(2-oxocyclopentyl)piperidin-1-yl]-N-propylacetamide
CID 79545157
2-(1-octylpiperidin-2-yl)cyclohexan-1-one
CID 79539887
N-cyclohexyl-2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]acetamide
CID 79535803
N-(2-methylbutan-2-yl)-2-[2-(2-oxocyclohexyl)pyrrolidin-1-yl]acetamide
CID 79536402
2-(2-cyclopropylpyrrolidin-1-yl)acetamide
CID 126996638

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
The IUPAC name of 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide (CID 79552802) is 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide is NC(=O)CN1CCCCC1C1CCCCC1=O.
What is the InChIKey of 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
The InChIKey is WIZUVNKINCRPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c14-13(17)9-15-8-4-3-6-11(15)10-5-1-2-7-12(10)16/h10-11H,1-9H2,(H2,14,17).
What are the key properties of 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide?
2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide has a molecular weight of 238.33 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 79552802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).