2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride

C17H24ClF3N2O2 — CID 166174067

IUPAC2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride
SMILESCC(C)NC(=O)COc1ccc(C(F)(F)F)cc1C1CCNCC1.Cl
InChIInChI=1S/C17H23F3N2O2.ClH/c1-11(2)22-16(23)10-24-15-4-3-13(17(18,19)20)9-14(15)12-5-7-21-8-6-12;/h3-4,9,11-12,21H,5-8,10H2,1-2H3,(H,22,23);1H
InChIKeyOKZLEJHQLZIRFA-UHFFFAOYSA-N
MW380.84 g/mol
LogP3.50
Rot. Bonds5

About 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride

2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride (PubChem CID 166174067) has the molecular formula C17H24ClF3N2O2 and a molecular weight of 380.84 g/mol. Its IUPAC name is 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride.

Molecular Properties

Compound Name2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride
PubChem CID166174067
Molecular FormulaC17H24ClF3N2O2
Molecular Weight380.84 g/mol
Exact Mass380.15
IUPAC Name2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride
SMILESCC(C)NC(=O)COc1ccc(C(F)(F)F)cc1C1CCNCC1.Cl
InChIInChI=1S/C17H23F3N2O2.ClH/c1-11(2)22-16(23)10-24-15-4-3-13(17(18,19)20)9-14(15)12-5-7-21-8-6-12;/h3-4,9,11-12,21H,5-8,10H2,1-2H3,(H,22,23);1H
InChIKeyOKZLEJHQLZIRFA-UHFFFAOYSA-N
XLogP3.50
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.84
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride 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

1-(3-methylpiperidin-1-yl)-2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]ethanone;hydrochloride
CID 166174081
2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-1-pyrrolidin-1-ylethanone
CID 166174078
1-(4-methylpiperidin-1-yl)-2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]ethanone;hydrochloride
CID 166174085
3-methoxy-N-methyl-4-[2-oxo-2-(propan-2-ylamino)ethoxy]-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443929
2-[4-amino-2-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide
CID 61389475
4-[2-(methoxymethoxy)-5-(trifluoromethyl)phenyl]cyclohexane-1-carboxylic acid
CID 171115863
4-[2-oxo-2-(propan-2-ylamino)ethoxy]-3-(trifluoromethyl)benzoic acid
CID 63320445
4-[5-tert-butyl-2-(cyclohexylmethoxy)phenyl]piperidine;hydrochloride
CID 171109278
N-[2-ethoxy-5-(trifluoromethyl)phenyl]-3-piperidin-4-ylbutanamide
CID 119744029
1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol
CID 156722310
3-fluoro-4-piperidin-4-yl-N-propan-2-ylbenzamide
CID 169452672
tert-butyl N-[[4-(2-amino-2-oxoethoxy)-3-piperidin-4-ylphenyl]methyl]carbamate
CID 67257166

Frequently Asked Questions

What is the IUPAC name of 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride?
The IUPAC name of 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride (CID 166174067) is 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride.
What is the SMILES notation for 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride?
The canonical SMILES for 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride is CC(C)NC(=O)COc1ccc(C(F)(F)F)cc1C1CCNCC1.Cl.
What is the InChIKey of 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride?
The InChIKey is OKZLEJHQLZIRFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23F3N2O2.ClH/c1-11(2)22-16(23)10-24-15-4-3-13(17(18,19)20)9-14(15)12-5-7-21-8-6-12;/h3-4,9,11-12,21H,5-8,10H2,1-2H3,(H,22,23);1H.
What are the key properties of 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride?
2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride has a molecular weight of 380.84 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride is sourced from PubChem (CID 166174067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).