2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide

C17H26N2O2 — CID 119428082

IUPAC2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide
SMILESCC(C)(C)c1ccc(OCC(=O)NC2CCCNC2)cc1
InChIInChI=1S/C17H26N2O2/c1-17(2,3)13-6-8-15(9-7-13)21-12-16(20)19-14-5-4-10-18-11-14/h6-9,14,18H,4-5,10-12H2,1-3H3,(H,19,20)
InChIKeyYHKXSRMCYDKVDP-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.23
Rot. Bonds4

About 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide

2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide (PubChem CID 119428082) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide.

Molecular Properties

Compound Name2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide
PubChem CID119428082
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide
SMILESCC(C)(C)c1ccc(OCC(=O)NC2CCCNC2)cc1
InChIInChI=1S/C17H26N2O2/c1-17(2,3)13-6-8-15(9-7-13)21-12-16(20)19-14-5-4-10-18-11-14/h6-9,14,18H,4-5,10-12H2,1-3H3,(H,19,20)
InChIKeyYHKXSRMCYDKVDP-UHFFFAOYSA-N
XLogP2.23
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[2-oxo-2-(piperidin-3-ylamino)ethoxy]benzamide
CID 119426792
2-(4-methylphenoxy)-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 94803257
2-(4-methylphenoxy)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119450091
2-(4-benzoylphenoxy)-N-piperidin-3-ylacetamide
CID 119426216
2-(4-ethylphenoxy)-N-pyrrolidin-3-ylacetamide
CID 119450074
2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride
CID 119426969
N-piperidin-3-yl-2-[3-(trifluoromethyl)phenoxy]acetamide;hydrochloride
CID 119425494
4-tert-butyl-N-[3-oxo-3-(piperidin-3-ylamino)propyl]benzamide
CID 119426239
4-[2-oxo-2-(pyrrolidin-3-ylamino)ethoxy]benzamide
CID 119451956
2-(4-tert-butylphenoxy)-N-(1-methylsulfonylpiperidin-4-yl)acetamide
CID 46419745
2-methyl-2-[4-(2-methylpropoxy)phenyl]-N-piperidin-3-ylpropanamide
CID 119426016
2-(4-iodophenoxy)-N-piperidin-4-ylacetamide
CID 119389070

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide?
The IUPAC name of 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide (CID 119428082) is 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide.
What is the SMILES notation for 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide?
The canonical SMILES for 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide is CC(C)(C)c1ccc(OCC(=O)NC2CCCNC2)cc1.
What is the InChIKey of 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide?
The InChIKey is YHKXSRMCYDKVDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-17(2,3)13-6-8-15(9-7-13)21-12-16(20)19-14-5-4-10-18-11-14/h6-9,14,18H,4-5,10-12H2,1-3H3,(H,19,20).
What are the key properties of 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide?
2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide is sourced from PubChem (CID 119428082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).