2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide

C14H17F3N2O2 — CID 172825919

IUPAC2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide
SMILESNC(=O)c1ccccc1OC1CCCCN1CC(F)(F)F
InChIInChI=1S/C14H17F3N2O2/c15-14(16,17)9-19-8-4-3-7-12(19)21-11-6-2-1-5-10(11)13(18)20/h1-2,5-6,12H,3-4,7-9H2,(H2,18,20)
InChIKeyUVZXEYSUHHZXLK-UHFFFAOYSA-N
MW302.30 g/mol
LogP2.54
Rot. Bonds4

About 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide

2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide (PubChem CID 172825919) has the molecular formula C14H17F3N2O2 and a molecular weight of 302.30 g/mol. Its IUPAC name is 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide.

Molecular Properties

Compound Name2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide
PubChem CID172825919
Molecular FormulaC14H17F3N2O2
Molecular Weight302.30 g/mol
Exact Mass302.12
IUPAC Name2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide
SMILESNC(=O)c1ccccc1OC1CCCCN1CC(F)(F)F
InChIInChI=1S/C14H17F3N2O2/c15-14(16,17)9-19-8-4-3-7-12(19)21-11-6-2-1-5-10(11)13(18)20/h1-2,5-6,12H,3-4,7-9H2,(H2,18,20)
InChIKeyUVZXEYSUHHZXLK-UHFFFAOYSA-N
XLogP2.54
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(oxetan-2-yloxy)benzamide
CID 172814860
2-(2,2,2-trifluoroethoxy)benzamide;hydrochloride
CID 160645363
2-[2-(trifluoromethyl)phenoxy]piperidine-1-carboxylic acid
CID 68836477
2-(2-cyclopropyl-2-oxoethoxy)benzamide
CID 63913562
2-(2-cyanocycloheptyl)oxybenzamide
CID 43292463
2-(oxolan-3-yloxy)benzamide
CID 68643948
1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 62037237
2-[2-oxo-2-(piperidin-1-ylamino)ethoxy]benzamide
CID 9083909
2-[(2-methylpiperidin-1-yl)methoxy]benzoic acid
CID 20986481
2-(3,3,3-trifluoro-2-hydroxypropoxy)benzamide
CID 69220886
2-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethoxy]benzamide
CID 7283918
2-[2-[(3S)-3-hydroxypiperidin-1-yl]-2-oxoethoxy]benzamide
CID 107224218

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide?
The IUPAC name of 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide (CID 172825919) is 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide.
What is the SMILES notation for 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide?
The canonical SMILES for 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide is NC(=O)c1ccccc1OC1CCCCN1CC(F)(F)F.
What is the InChIKey of 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide?
The InChIKey is UVZXEYSUHHZXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O2/c15-14(16,17)9-19-8-4-3-7-12(19)21-11-6-2-1-5-10(11)13(18)20/h1-2,5-6,12H,3-4,7-9H2,(H2,18,20).
What are the key properties of 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide?
2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide has a molecular weight of 302.30 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]oxybenzamide is sourced from PubChem (CID 172825919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).