N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride

C15H20ClF3N2O3 — CID 119425290

IUPACN-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
SMILESCl.O=C(COc1ccccc1OCC(F)(F)F)NC1CCCNC1
InChIInChI=1S/C15H19F3N2O3.ClH/c16-15(17,18)10-23-13-6-2-1-5-12(13)22-9-14(21)20-11-4-3-7-19-8-11;/h1-2,5-6,11,19H,3-4,7-10H2,(H,20,21);1H
InChIKeyYSYQHWIPDQDTHC-UHFFFAOYSA-N
MW368.78 g/mol
LogP2.30
Rot. Bonds6

About N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride

N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride (PubChem CID 119425290) has the molecular formula C15H20ClF3N2O3 and a molecular weight of 368.78 g/mol. Its IUPAC name is N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
PubChem CID119425290
Molecular FormulaC15H20ClF3N2O3
Molecular Weight368.78 g/mol
Exact Mass368.11
IUPAC NameN-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
SMILESCl.O=C(COc1ccccc1OCC(F)(F)F)NC1CCCNC1
InChIInChI=1S/C15H19F3N2O3.ClH/c16-15(17,18)10-23-13-6-2-1-5-12(13)22-9-14(21)20-11-4-3-7-19-8-11;/h1-2,5-6,11,19H,3-4,7-10H2,(H,20,21);1H
InChIKeyYSYQHWIPDQDTHC-UHFFFAOYSA-N
XLogP2.30
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.78
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-tert-butylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride
CID 119426969
2-naphthalen-1-yloxy-N-piperidin-3-ylacetamide;hydrochloride
CID 119426850
2-(2-phenylphenoxy)-N-piperidin-3-ylacetamide;hydrochloride
CID 119424815
2-(2-nitrophenoxy)-N-piperidin-3-ylacetamide
CID 119426166
N-piperidin-3-yl-2-[3-(trifluoromethyl)phenoxy]acetamide;hydrochloride
CID 119425494
N-piperidin-3-yl-2-[2-(trifluoromethyl)phenyl]acetamide
CID 119426295
2-(4-benzoylphenoxy)-N-piperidin-3-ylacetamide
CID 119426216
2-(2-fluorophenoxy)-N-piperidin-4-ylacetamide
CID 110488066
2-(2-methoxyphenoxy)-N-piperidin-4-ylacetamide
CID 28810945
2-(4-tert-butylphenoxy)-N-piperidin-3-ylacetamide
CID 119428082
N-[2-(aminomethyl)cyclopentyl]-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
CID 119601561
N-piperidin-3-yl-2-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 119428934

Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride?
The IUPAC name of N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride (CID 119425290) is N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride.
What is the SMILES notation for N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride?
The canonical SMILES for N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride is Cl.O=C(COc1ccccc1OCC(F)(F)F)NC1CCCNC1.
What is the InChIKey of N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride?
The InChIKey is YSYQHWIPDQDTHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O3.ClH/c16-15(17,18)10-23-13-6-2-1-5-12(13)22-9-14(21)20-11-4-3-7-19-8-11;/h1-2,5-6,11,19H,3-4,7-10H2,(H,20,21);1H.
What are the key properties of N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride?
N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride has a molecular weight of 368.78 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride is sourced from PubChem (CID 119425290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).