2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride

C17H27ClN2O2 — CID 119426969

IUPAC2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride
SMILESCC(C)(C)c1ccccc1OCC(=O)NC1CCCNC1.Cl
InChIInChI=1S/C17H26N2O2.ClH/c1-17(2,3)14-8-4-5-9-15(14)21-12-16(20)19-13-7-6-10-18-11-13;/h4-5,8-9,13,18H,6-7,10-12H2,1-3H3,(H,19,20);1H
InChIKeyYXUUACAJHAGMCC-UHFFFAOYSA-N
MW326.87 g/mol
LogP2.65
Rot. Bonds4

About 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride

2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride (PubChem CID 119426969) has the molecular formula C17H27ClN2O2 and a molecular weight of 326.87 g/mol. Its IUPAC name is 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride
PubChem CID119426969
Molecular FormulaC17H27ClN2O2
Molecular Weight326.87 g/mol
Exact Mass326.18
IUPAC Name2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride
SMILESCC(C)(C)c1ccccc1OCC(=O)NC1CCCNC1.Cl
InChIInChI=1S/C17H26N2O2.ClH/c1-17(2,3)14-8-4-5-9-15(14)21-12-16(20)19-13-7-6-10-18-11-13;/h4-5,8-9,13,18H,6-7,10-12H2,1-3H3,(H,19,20);1H
InChIKeyYXUUACAJHAGMCC-UHFFFAOYSA-N
XLogP2.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.87
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
CID 119425290
2-(2-tert-butylphenoxy)-N-(3-methylpiperidin-4-yl)acetamide
CID 120556447
2-naphthalen-1-yloxy-N-piperidin-3-ylacetamide;hydrochloride
CID 119426850
2-(2-phenylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride
CID 119424815
2-(2-tert-butylphenoxy)-N-[2-[[2-(2-tert-butylphenoxy)acetyl]amino]cyclohexyl]acetamide
CID 17051386
2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide
CID 119428082
N-piperidin-3-yl-2-[2-(trifluoromethyl)phenyl]acetamide
CID 119426295
2-(2-nitrophenoxy)-N-piperidin-3-ylacetamide
CID 119426166
N-piperidin-3-yl-2-[3-(trifluoromethyl)phenoxy]acetamide;hydrochloride
CID 119425494
2-(2-tert-butylphenoxy)-N-[1-[(3R)-oxolan-3-yl]piperidin-4-yl]acetamide
CID 96542515
2-(4-benzoylphenoxy)-N-piperidin-3-ylacetamide
CID 119426216
2-(2-fluorophenoxy)-N-piperidin-4-ylacetamide
CID 110488066

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride?
The IUPAC name of 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride (CID 119426969) is 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride.
What is the SMILES notation for 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride?
The canonical SMILES for 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride is CC(C)(C)c1ccccc1OCC(=O)NC1CCCNC1.Cl.
What is the InChIKey of 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride?
The InChIKey is YXUUACAJHAGMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2.ClH/c1-17(2,3)14-8-4-5-9-15(14)21-12-16(20)19-13-7-6-10-18-11-13;/h4-5,8-9,13,18H,6-7,10-12H2,1-3H3,(H,19,20);1H.
What are the key properties of 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride?
2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride has a molecular weight of 326.87 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride is sourced from PubChem (CID 119426969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).