N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide

C20H24N2O2 — CID 854438

IUPACN-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C20H24N2O2/c23-20(16-24-19-9-5-2-6-10-19)21-18-11-13-22(14-12-18)15-17-7-3-1-4-8-17/h1-10,18H,11-16H2,(H,21,23)
InChIKeyBXGXZNHKLABWBG-UHFFFAOYSA-N
MW324.42 g/mol
LogP2.85
Rot. Bonds6

About N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide

N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide (PubChem CID 854438) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide
PubChem CID854438
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C20H24N2O2/c23-20(16-24-19-9-5-2-6-10-19)21-18-11-13-22(14-12-18)15-17-7-3-1-4-8-17/h1-10,18H,11-16H2,(H,21,23)
InChIKeyBXGXZNHKLABWBG-UHFFFAOYSA-N
XLogP2.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide (CID 854438) is N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide is O=C(COc1ccccc1)NC1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide?
The InChIKey is BXGXZNHKLABWBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-20(16-24-19-9-5-2-6-10-19)21-18-11-13-22(14-12-18)15-17-7-3-1-4-8-17/h1-10,18H,11-16H2,(H,21,23).
What are the key properties of N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide?
N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide has a molecular weight of 324.42 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-2-phenoxyacetamide is sourced from PubChem (CID 854438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).