N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide

C20H24N2O2 — CID 118541555

IUPACN-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCCN(Cc2ccccc2)C1)C(O)c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-19(17-10-5-2-6-11-17)20(24)21-18-12-7-13-22(15-18)14-16-8-3-1-4-9-16/h1-6,8-11,18-19,23H,7,12-15H2,(H,21,24)
InChIKeyDJVNNOCKQAOQKT-UHFFFAOYSA-N
MW324.42 g/mol
LogP2.50
Rot. Bonds5

About N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide

N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide (PubChem CID 118541555) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide
PubChem CID118541555
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCCN(Cc2ccccc2)C1)C(O)c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-19(17-10-5-2-6-11-17)20(24)21-18-12-7-13-22(15-18)14-16-8-3-1-4-9-16/h1-6,8-11,18-19,23H,7,12-15H2,(H,21,24)
InChIKeyDJVNNOCKQAOQKT-UHFFFAOYSA-N
XLogP2.50
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide?
The IUPAC name of N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide (CID 118541555) is N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide?
The canonical SMILES for N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide is O=C(NC1CCCN(Cc2ccccc2)C1)C(O)c1ccccc1.
What is the InChIKey of N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide?
The InChIKey is DJVNNOCKQAOQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-19(17-10-5-2-6-11-17)20(24)21-18-12-7-13-22(15-18)14-16-8-3-1-4-9-16/h1-6,8-11,18-19,23H,7,12-15H2,(H,21,24).
What are the key properties of N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide?
N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide has a molecular weight of 324.42 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-3-yl)-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 118541555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).