N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride

C16H26ClN3O — CID 119912897

IUPACN-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
SMILESCN(Cc1ccccc1)C(=O)CN(C)C1CCNCC1.Cl
InChIInChI=1S/C16H25N3O.ClH/c1-18(15-8-10-17-11-9-15)13-16(20)19(2)12-14-6-4-3-5-7-14;/h3-7,15,17H,8-13H2,1-2H3;1H
InChIKeyCCAMCNCFOLUXFC-UHFFFAOYSA-N
MW311.86 g/mol
LogP1.75
Rot. Bonds5

About N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride

N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride (PubChem CID 119912897) has the molecular formula C16H26ClN3O and a molecular weight of 311.86 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
PubChem CID119912897
Molecular FormulaC16H26ClN3O
Molecular Weight311.86 g/mol
Exact Mass311.18
IUPAC NameN-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
SMILESCN(Cc1ccccc1)C(=O)CN(C)C1CCNCC1.Cl
InChIInChI=1S/C16H25N3O.ClH/c1-18(15-8-10-17-11-9-15)13-16(20)19(2)12-14-6-4-3-5-7-14;/h3-7,15,17H,8-13H2,1-2H3;1H
InChIKeyCCAMCNCFOLUXFC-UHFFFAOYSA-N
XLogP1.75
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.86
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride
CID 119669861
N-[[2-(dimethylamino)pyrimidin-5-yl]methyl]-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide
CID 166314343
benzyl(piperidin-4-yl)carbamic acid
CID 54298382
N-benzyl-N-methylpiperidine-4-carboxamide
CID 5103038
2-[azepan-4-yl(methyl)amino]-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 104979626
2-[azetidin-3-yl(ethyl)amino]-N-benzyl-N-methylacetamide
CID 66181525
3-[[benzyl(methyl)carbamoyl]amino]-N-methyl-N-piperidin-4-ylpropanamide
CID 119442803
N-benzyl-N-methylpyrrolidin-3-amine
CID 14834678
N-benzyl-2-[cyclopropyl(methylsulfonyl)amino]-N-methylacetamide
CID 113147870
2-phenyl-N-(2-phenylacetyl)-N-piperidin-4-ylacetamide
CID 173425249
N,N'-dibenzyl-N,N'-dimethylpropanediamide
CID 2392235
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-3-piperidin-4-ylbutanamide
CID 119719399

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
The IUPAC name of N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride (CID 119912897) is N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
The canonical SMILES for N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride is CN(Cc1ccccc1)C(=O)CN(C)C1CCNCC1.Cl.
What is the InChIKey of N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
The InChIKey is CCAMCNCFOLUXFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O.ClH/c1-18(15-8-10-17-11-9-15)13-16(20)19(2)12-14-6-4-3-5-7-14;/h3-7,15,17H,8-13H2,1-2H3;1H.
What are the key properties of N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride has a molecular weight of 311.86 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119912897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).