2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide

C16H24N2O2 — CID 119441590

IUPAC2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide
SMILESCCc1ccccc1OCC(=O)N(C)C1CCNCC1
InChIInChI=1S/C16H24N2O2/c1-3-13-6-4-5-7-15(13)20-12-16(19)18(2)14-8-10-17-11-9-14/h4-7,14,17H,3,8-12H2,1-2H3
InChIKeyBNIXZZJKVDJYNN-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.84
Rot. Bonds5

About 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide

2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide (PubChem CID 119441590) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide.

Molecular Properties

Compound Name2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide
PubChem CID119441590
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide
SMILESCCc1ccccc1OCC(=O)N(C)C1CCNCC1
InChIInChI=1S/C16H24N2O2/c1-3-13-6-4-5-7-15(13)20-12-16(19)18(2)14-8-10-17-11-9-14/h4-7,14,17H,3,8-12H2,1-2H3
InChIKeyBNIXZZJKVDJYNN-UHFFFAOYSA-N
XLogP1.84
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide?
The IUPAC name of 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide (CID 119441590) is 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide.
What is the SMILES notation for 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide?
The canonical SMILES for 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide is CCc1ccccc1OCC(=O)N(C)C1CCNCC1.
What is the InChIKey of 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide?
The InChIKey is BNIXZZJKVDJYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-13-6-4-5-7-15(13)20-12-16(19)18(2)14-8-10-17-11-9-14/h4-7,14,17H,3,8-12H2,1-2H3.
What are the key properties of 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide?
2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide has a molecular weight of 276.38 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide is sourced from PubChem (CID 119441590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).