N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide

C20H32N2O — CID 57224733

IUPACN-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide
SMILESCCC1(C)CC(NC(=O)c2ccccc2C)C(C)C(C)(CC)N1
InChIInChI=1S/C20H32N2O/c1-7-19(5)13-17(15(4)20(6,8-2)22-19)21-18(23)16-12-10-9-11-14(16)3/h9-12,15,17,22H,7-8,13H2,1-6H3,(H,21,23)
InChIKeyDUJHJYIADAOENO-UHFFFAOYSA-N
MW316.49 g/mol
LogP4.06
Rot. Bonds4

About N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide

N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide (PubChem CID 57224733) has the molecular formula C20H32N2O and a molecular weight of 316.49 g/mol. Its IUPAC name is N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide
PubChem CID57224733
Molecular FormulaC20H32N2O
Molecular Weight316.49 g/mol
Exact Mass316.25
IUPAC NameN-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide
SMILESCCC1(C)CC(NC(=O)c2ccccc2C)C(C)C(C)(CC)N1
InChIInChI=1S/C20H32N2O/c1-7-19(5)13-17(15(4)20(6,8-2)22-19)21-18(23)16-12-10-9-11-14(16)3/h9-12,15,17,22H,7-8,13H2,1-6H3,(H,21,23)
InChIKeyDUJHJYIADAOENO-UHFFFAOYSA-N
XLogP4.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.49
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminocyclopropyl)-2-methylbenzamide
CID 43593725
N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)but-2-enamide
CID 54167766
2-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)oxycarbonylbenzoic acid
CID 23344692
2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide;hydrochloride
CID 126477708
tetrakis(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate
CID 21330487
2-methyl-N-[(1S,2S)-2-[(2-methylbenzoyl)amino]cyclohexyl]benzamide
CID 979091
2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide
CID 124516930
N-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-2-methylbenzamide
CID 958830
N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride
CID 119609179
N-cyclopropyl-2-methylbenzamide;hydrochloride
CID 162767207
N-(2-bromo-2-phenylethyl)-2-methylbenzamide
CID 114308218

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide?
The IUPAC name of N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide (CID 57224733) is N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide.
What is the SMILES notation for N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide?
The canonical SMILES for N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide is CCC1(C)CC(NC(=O)c2ccccc2C)C(C)C(C)(CC)N1.
What is the InChIKey of N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide?
The InChIKey is DUJHJYIADAOENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O/c1-7-19(5)13-17(15(4)20(6,8-2)22-19)21-18(23)16-12-10-9-11-14(16)3/h9-12,15,17,22H,7-8,13H2,1-6H3,(H,21,23).
What are the key properties of N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide?
N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide has a molecular weight of 316.49 g/mol, XLogP of 4.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)-2-methylbenzamide is sourced from PubChem (CID 57224733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).