N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide

C18H28N2O — CID 109020436

IUPACN-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide
SMILESCCC1CCCCN1CCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C18H28N2O/c1-3-17-11-7-8-13-20(17)14-12-18(21)19(2)15-16-9-5-4-6-10-16/h4-6,9-10,17H,3,7-8,11-15H2,1-2H3
InChIKeyFUEJUDSZEIAJSC-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.30
Rot. Bonds6

About N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide

N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide (PubChem CID 109020436) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide.

Molecular Properties

Compound NameN-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide
PubChem CID109020436
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide
SMILESCCC1CCCCN1CCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C18H28N2O/c1-3-17-11-7-8-13-20(17)14-12-18(21)19(2)15-16-9-5-4-6-10-16/h4-6,9-10,17H,3,7-8,11-15H2,1-2H3
InChIKeyFUEJUDSZEIAJSC-UHFFFAOYSA-N
XLogP3.30
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-3-(2-ethylpiperidin-1-yl)-N-phenylpropanamide
CID 109032779
N-benzyl-3-[[N-[2-(2-ethylpiperidin-1-yl)ethyl]-N'-methylcarbamimidoyl]amino]-N-methylpropanamide
CID 111568195
N-benzyl-2-(2-formylpiperidin-1-yl)-N-methylacetamide
CID 62656234
N-benzyl-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-methylacetamide
CID 78942574
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-benzyl-N-methylacetamide;hydrochloride
CID 119927034
N-benzyl-4-(2-ethylpiperidine-1-carbonyl)-N-methylbenzamide
CID 109047100
3-[(2R)-2-benzylpiperidin-1-yl]propanoic acid
CID 97214231
2-[2-(1-aminoethyl)piperidin-1-yl]-N-benzyl-N-methylacetamide
CID 63255807
1-(2-ethylazepan-1-yl)-3-phenylpropan-2-one
CID 113441826
N-benzyl-5-(2-ethylpiperidin-1-yl)-N-methylpyridine-2-carboxamide
CID 109189130
N-benzyl-3-(4-benzylpiperazin-1-yl)-N-methylpropanamide
CID 109020407
2-[(2R)-2-[[benzyl(methyl)amino]methyl]piperidin-1-yl]ethanol
CID 96554125

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide?
The IUPAC name of N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide (CID 109020436) is N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide.
What is the SMILES notation for N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide?
The canonical SMILES for N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide is CCC1CCCCN1CCC(=O)N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide?
The InChIKey is FUEJUDSZEIAJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-3-17-11-7-8-13-20(17)14-12-18(21)19(2)15-16-9-5-4-6-10-16/h4-6,9-10,17H,3,7-8,11-15H2,1-2H3.
What are the key properties of N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide?
N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide has a molecular weight of 288.44 g/mol, XLogP of 3.30, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(2-ethylpiperidin-1-yl)-N-methylpropanamide is sourced from PubChem (CID 109020436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).