1-[(2R)-1-acetylpiperidin-2-yl]ethanone

C9H15NO2 — CID 58356057

IUPAC1-[(2R)-1-acetylpiperidin-2-yl]ethanone
SMILESCC(=O)[C@H]1CCCCN1C(C)=O
InChIInChI=1S/C9H15NO2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h9H,3-6H2,1-2H3/t9-/m1/s1
InChIKeyMJKOCEMEUNEYCS-SECBINFHSA-N
MW169.22 g/mol
LogP0.98
Rot. Bonds1

About 1-[(2R)-1-acetylpiperidin-2-yl]ethanone

1-[(2R)-1-acetylpiperidin-2-yl]ethanone (PubChem CID 58356057) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 1-[(2R)-1-acetylpiperidin-2-yl]ethanone.

Molecular Properties

Compound Name1-[(2R)-1-acetylpiperidin-2-yl]ethanone
PubChem CID58356057
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name1-[(2R)-1-acetylpiperidin-2-yl]ethanone
SMILESCC(=O)[C@H]1CCCCN1C(C)=O
InChIInChI=1S/C9H15NO2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h9H,3-6H2,1-2H3/t9-/m1/s1
InChIKeyMJKOCEMEUNEYCS-SECBINFHSA-N
XLogP0.98
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(2R)-1-acetylpiperidin-2-yl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-acetylpiperidine-2-carboxylic acid;ethane
CID 144674830
1-(2-acetylpiperidin-1-yl)-2,2-dimethylpropan-1-one
CID 58171936
1-acetyl-N-methylpiperidine-2-carboxamide
CID 10607550
1-(1-acetylpiperidin-2-yl)propan-1-one
CID 45119530
1-[(2S)-2-acetylpyrrolidin-1-yl]propane-1,2-dione
CID 59063523
1-(2-hydroxypiperidin-1-yl)ethanone
CID 70448488
1-(2-acetylpiperidin-1-yl)-2-methylpropan-1-one;ethane;prop-1-ene
CID 142110127
ethane;1-(2-methylazepan-1-yl)ethanone
CID 143677776
1-(2-acetylpyrrolidin-1-yl)-2-aminoethanone;ethane
CID 166119423
1-[(2S)-2-acetylpyrrolidin-1-yl]prop-2-en-1-one
CID 176716114
1-[2-[2-(1-aminoethyl)piperidine-1-carbonyl]pyrrolidin-1-yl]ethanone
CID 119434406
(2R)-1-acetyl-N-diazenylpiperidine-2-carboxamide
CID 137017627

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-1-acetylpiperidin-2-yl]ethanone?
The IUPAC name of 1-[(2R)-1-acetylpiperidin-2-yl]ethanone (CID 58356057) is 1-[(2R)-1-acetylpiperidin-2-yl]ethanone.
What is the SMILES notation for 1-[(2R)-1-acetylpiperidin-2-yl]ethanone?
The canonical SMILES for 1-[(2R)-1-acetylpiperidin-2-yl]ethanone is CC(=O)[C@H]1CCCCN1C(C)=O.
What is the InChIKey of 1-[(2R)-1-acetylpiperidin-2-yl]ethanone?
The InChIKey is MJKOCEMEUNEYCS-SECBINFHSA-N. The full InChI is InChI=1S/C9H15NO2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h9H,3-6H2,1-2H3/t9-/m1/s1.
What are the key properties of 1-[(2R)-1-acetylpiperidin-2-yl]ethanone?
1-[(2R)-1-acetylpiperidin-2-yl]ethanone has a molecular weight of 169.22 g/mol, XLogP of 0.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-1-acetylpiperidin-2-yl]ethanone is sourced from PubChem (CID 58356057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).