2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide

C16H24N2O2 — CID 119460422

IUPAC2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
SMILESCCc1ccc(OCC(=O)NCC2CCCNC2)cc1
InChIInChI=1S/C16H24N2O2/c1-2-13-5-7-15(8-6-13)20-12-16(19)18-11-14-4-3-9-17-10-14/h5-8,14,17H,2-4,9-12H2,1H3,(H,18,19)
InChIKeyRFBYNQRRLAFHOD-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.74
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide

2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide (PubChem CID 119460422) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
PubChem CID119460422
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
SMILESCCc1ccc(OCC(=O)NCC2CCCNC2)cc1
InChIInChI=1S/C16H24N2O2/c1-2-13-5-7-15(8-6-13)20-12-16(19)18-11-14-4-3-9-17-10-14/h5-8,14,17H,2-4,9-12H2,1H3,(H,18,19)
InChIKeyRFBYNQRRLAFHOD-UHFFFAOYSA-N
XLogP1.74
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenoxy-N-(piperidin-3-ylmethyl)acetamide
CID 60725547
4-[2-oxo-2-(piperidin-3-ylmethylamino)ethoxy]benzamide
CID 119462303
2-(3,4-dimethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119461053
2-(4-chloro-3-methylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119462343
2-[4-(1,3-dithian-2-yl)phenoxy]-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119460626
2-(3-acetylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119463561
2-(2,6-dimethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119464381
2-(4-ethylphenoxy)-N-pyrrolidin-3-ylacetamide
CID 119450074
N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride
CID 119555166
N-[[(3S)-piperidin-3-yl]methyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 99626862
N-(piperidin-3-ylmethyl)-2-[4-(trifluoromethoxy)phenyl]acetamide;hydrochloride
CID 119464429
2-(2,4-dimethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119462971

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide (CID 119460422) is 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide is CCc1ccc(OCC(=O)NCC2CCCNC2)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide?
The InChIKey is RFBYNQRRLAFHOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-2-13-5-7-15(8-6-13)20-12-16(19)18-11-14-4-3-9-17-10-14/h5-8,14,17H,2-4,9-12H2,1H3,(H,18,19).
What are the key properties of 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide?
2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 1.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide is sourced from PubChem (CID 119460422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).