N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide

C16H22N2O2 — CID 110757185

IUPACN-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCC1CCCC(C)N1C(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-12-7-6-8-13(2)18(12)15(19)11-17-16(20)14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3,(H,17,20)
InChIKeyABHZGGKUTQIVIL-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.21
Rot. Bonds3

About N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide

N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide (PubChem CID 110757185) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide
PubChem CID110757185
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCC1CCCC(C)N1C(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-12-7-6-8-13(2)18(12)15(19)11-17-16(20)14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3,(H,17,20)
InChIKeyABHZGGKUTQIVIL-UHFFFAOYSA-N
XLogP2.21
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl] 2-benzamidoacetate
CID 9319445
[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl] 2-[(4-phenylbenzoyl)amino]acetate
CID 7854688
[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl] 2-[[4-(trifluoromethyl)benzoyl]amino]acetate
CID 7880632
[(2R)-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-1-oxopropan-2-yl] 2-[(4-phenylbenzoyl)amino]acetate
CID 7854648
N-[2-(2,4-dimethylpiperazin-1-yl)-2-oxoethyl]benzamide
CID 110741126
N-[2-(dimethylamino)-2-oxoethyl]-4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethoxy]benzamide
CID 55378182
3-iodo-N-[2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxoethyl]benzamide
CID 59282800
1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-phenylsulfanylethanone
CID 2355287
1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-phenylsulfanylethanone
CID 2355289
1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-3,3-diphenylpropan-1-one
CID 40599711
methyl N-[1-(2-benzamidoacetyl)piperidin-4-yl]carbamate
CID 110821590
[2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl] 2-[(3-nitrobenzoyl)amino]acetate
CID 7843734

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide?
The IUPAC name of N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide (CID 110757185) is N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide is CC1CCCC(C)N1C(=O)CNC(=O)c1ccccc1.
What is the InChIKey of N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide?
The InChIKey is ABHZGGKUTQIVIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12-7-6-8-13(2)18(12)15(19)11-17-16(20)14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3,(H,17,20).
What are the key properties of N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide?
N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide has a molecular weight of 274.36 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide is sourced from PubChem (CID 110757185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).