2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide

C17H24N2O3 — CID 111913601

IUPAC2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide
SMILESO=C(CN1CCCCC1CCO)NCC(=O)c1ccccc1
InChIInChI=1S/C17H24N2O3/c20-11-9-15-8-4-5-10-19(15)13-17(22)18-12-16(21)14-6-2-1-3-7-14/h1-3,6-7,15,20H,4-5,8-13H2,(H,18,22)
InChIKeyBMWUHMXPJIQWNQ-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.22
Rot. Bonds7

About 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide

2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide (PubChem CID 111913601) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide
PubChem CID111913601
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide
SMILESO=C(CN1CCCCC1CCO)NCC(=O)c1ccccc1
InChIInChI=1S/C17H24N2O3/c20-11-9-15-8-4-5-10-19(15)13-17(22)18-12-16(21)14-6-2-1-3-7-14/h1-3,6-7,15,20H,4-5,8-13H2,(H,18,22)
InChIKeyBMWUHMXPJIQWNQ-UHFFFAOYSA-N
XLogP1.22
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide?
The IUPAC name of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide (CID 111913601) is 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide.
What is the SMILES notation for 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide?
The canonical SMILES for 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide is O=C(CN1CCCCC1CCO)NCC(=O)c1ccccc1.
What is the InChIKey of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide?
The InChIKey is BMWUHMXPJIQWNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-11-9-15-8-4-5-10-19(15)13-17(22)18-12-16(21)14-6-2-1-3-7-14/h1-3,6-7,15,20H,4-5,8-13H2,(H,18,22).
What are the key properties of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide?
2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide has a molecular weight of 304.39 g/mol, XLogP of 1.22, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenacylacetamide is sourced from PubChem (CID 111913601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).