2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide

C12H22N2O2 — CID 63846538

IUPAC2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide
SMILESCC(=O)C1CCCCN1C(C)C(=O)N(C)C
InChIInChI=1S/C12H22N2O2/c1-9(12(16)13(3)4)14-8-6-5-7-11(14)10(2)15/h9,11H,5-8H2,1-4H3
InChIKeyMJZUBABFCFSBOE-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.91
Rot. Bonds3

About 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide

2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide (PubChem CID 63846538) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide
PubChem CID63846538
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide
SMILESCC(=O)C1CCCCN1C(C)C(=O)N(C)C
InChIInChI=1S/C12H22N2O2/c1-9(12(16)13(3)4)14-8-6-5-7-11(14)10(2)15/h9,11H,5-8H2,1-4H3
InChIKeyMJZUBABFCFSBOE-UHFFFAOYSA-N
XLogP0.91
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-aminobutyryl-(R)-pipecolinic acid amide
CID 11672950
N,N-diethyl-1-methylpiperidine-2-carboxamide
CID 68265026
1-Octylpiperidine-2-carboxamide
CID 162645640
1-Octanoylpiperidine-2-carboxamide
CID 162646892
1-[2-(2-Ethylpiperidine-1-carbonyl)pyrrolidin-1-YL]ethan-1-one
CID 53015943
1-Methyl-7-(4-propan-2-ylpiperazine-1-carbonyl)azepan-2-one
CID 110196293
1-Methyl-7-(piperidine-1-carbonyl)azepan-2-one
CID 110196296
1-((2r,5s)-2,4,5-Trimethylpiperazin-1-yl]hexan-1-one
CID 70698497
Dihexanoylpiperazine
CID 22596902
1-[4-(1-Ethylpiperidine-2-carbonyl)piperazin-1-yl]propan-1-one
CID 53546053
(2S)-1-acetyl-N-(cyanomethyl)-N-propylpiperidine-2-carboxamide
CID 99859036
1-Piperidinecarboxaldehyde, 2-acetyl-
CID 12436236

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide?
The IUPAC name of 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide (CID 63846538) is 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide.
What is the SMILES notation for 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide?
The canonical SMILES for 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide is CC(=O)C1CCCCN1C(C)C(=O)N(C)C.
What is the InChIKey of 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide?
The InChIKey is MJZUBABFCFSBOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-9(12(16)13(3)4)14-8-6-5-7-11(14)10(2)15/h9,11H,5-8H2,1-4H3.
What are the key properties of 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide?
2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide has a molecular weight of 226.32 g/mol, XLogP of 0.91, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylpiperidin-1-yl)-N,N-dimethylpropanamide is sourced from PubChem (CID 63846538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).