(2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide

C20H24N2O2 — CID 118541637

IUPAC(2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-19(17-9-5-2-6-10-17)20(24)21-18-11-13-22(14-12-18)15-16-7-3-1-4-8-16/h1-10,18-19,23H,11-15H2,(H,21,24)/t19-/m0/s1
InChIKeyOGLQKSYFVRIRFO-IBGZPJMESA-N
MW324.42 g/mol
LogP2.50
Rot. Bonds5

About (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide

(2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide (PubChem CID 118541637) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
PubChem CID118541637
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name(2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-19(17-9-5-2-6-10-17)20(24)21-18-11-13-22(14-12-18)15-16-7-3-1-4-8-16/h1-10,18-19,23H,11-15H2,(H,21,24)/t19-/m0/s1
InChIKeyOGLQKSYFVRIRFO-IBGZPJMESA-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 (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
The IUPAC name of (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide (CID 118541637) is (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
The canonical SMILES for (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide is O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H](O)c1ccccc1.
What is the InChIKey of (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
The InChIKey is OGLQKSYFVRIRFO-IBGZPJMESA-N. The full InChI is InChI=1S/C20H24N2O2/c23-19(17-9-5-2-6-10-17)20(24)21-18-11-13-22(14-12-18)15-16-7-3-1-4-8-16/h1-10,18-19,23H,11-15H2,(H,21,24)/t19-/m0/s1.
What are the key properties of (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
(2S)-N-(1-benzylpiperidin-4-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 (2S)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 118541637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).