N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide

C16H24N2O — CID 108997429

IUPACN-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide
SMILESCC1CCCN(CC(=O)N(C)Cc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-14-7-6-10-18(11-14)13-16(19)17(2)12-15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13H2,1-2H3
InChIKeyJENYTZVQTSUMTK-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.38
Rot. Bonds4

About N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide

N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide (PubChem CID 108997429) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide
PubChem CID108997429
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide
SMILESCC1CCCN(CC(=O)N(C)Cc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-14-7-6-10-18(11-14)13-16(19)17(2)12-15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13H2,1-2H3
InChIKeyJENYTZVQTSUMTK-UHFFFAOYSA-N
XLogP2.38
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-methyl-2-[3-(methylamino)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119905657
N-benzyl-N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]acetamide
CID 75462039
2-[3-(aminomethyl)pyrrolidin-1-yl]-N-benzyl-N-methylacetamide;hydrochloride
CID 119917902
N-benzyl-2-(3,5-dimethylpiperazin-1-yl)-N-methylacetamide
CID 63873691
N-(2-aminoethyl)-1-[2-[benzyl(methyl)amino]-2-oxoethyl]piperidine-3-carboxamide;hydrochloride
CID 119916928
2-(4-amino-3-ethylpiperidin-1-yl)-N-benzyl-N-methylacetamide
CID 81452559
N-benzyl-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-methylacetamide
CID 78942574
1-(4-benzylpiperazin-1-yl)-2-(3-methylpiperidin-1-yl)ethanone
CID 109002007
(3R)-1-[2-[methyl-[(4-methylphenyl)methyl]amino]-2-oxoethyl]-N-phenylpiperidine-3-carboxamide
CID 42538408
N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-2-[(3S)-3-phenylpiperidin-1-yl]acetamide
CID 97203898
N-benzyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-methylacetamide
CID 60645191
1-benzyl-3-methylpiperidine
CID 2794856

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide (CID 108997429) is N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide is CC1CCCN(CC(=O)N(C)Cc2ccccc2)C1.
What is the InChIKey of N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide?
The InChIKey is JENYTZVQTSUMTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-14-7-6-10-18(11-14)13-16(19)17(2)12-15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13H2,1-2H3.
What are the key properties of N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide?
N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.38, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-(3-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 108997429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).