N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride

C15H23ClN2O — CID 119669861

IUPACN-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride
SMILESCN(Cc1ccccc1)C(=O)CC1CCNCC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-17(12-14-5-3-2-4-6-14)15(18)11-13-7-9-16-10-8-13;/h2-6,13,16H,7-12H2,1H3;1H
InChIKeyWPRMOSHSEOJFBN-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.46
Rot. Bonds4

About N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride

N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride (PubChem CID 119669861) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride
PubChem CID119669861
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride
SMILESCN(Cc1ccccc1)C(=O)CC1CCNCC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-17(12-14-5-3-2-4-6-14)15(18)11-13-7-9-16-10-8-13;/h2-6,13,16H,7-12H2,1H3;1H
InChIKeyWPRMOSHSEOJFBN-UHFFFAOYSA-N
XLogP2.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride?
The IUPAC name of N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride (CID 119669861) is N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride.
What is the SMILES notation for N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride?
The canonical SMILES for N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride is CN(Cc1ccccc1)C(=O)CC1CCNCC1.Cl.
What is the InChIKey of N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride?
The InChIKey is WPRMOSHSEOJFBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-17(12-14-5-3-2-4-6-14)15(18)11-13-7-9-16-10-8-13;/h2-6,13,16H,7-12H2,1H3;1H.
What are the key properties of N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride?
N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-piperidin-4-ylacetamide;hydrochloride is sourced from PubChem (CID 119669861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).