N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide

C19H19F3N2O2 — CID 12999550

IUPACN-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(Oc2cccc(C(F)(F)F)c2)CC1
InChIInChI=1S/C19H19F3N2O2/c20-19(21,22)14-5-4-8-17(13-14)26-16-9-11-24(12-10-16)18(25)23-15-6-2-1-3-7-15/h1-8,13,16H,9-12H2,(H,23,25)
InChIKeyTUVQWDAMBHZWCE-UHFFFAOYSA-N
MW364.37 g/mol
LogP4.78
Rot. Bonds3

About N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide

N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide (PubChem CID 12999550) has the molecular formula C19H19F3N2O2 and a molecular weight of 364.37 g/mol. Its IUPAC name is N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide
PubChem CID12999550
Molecular FormulaC19H19F3N2O2
Molecular Weight364.37 g/mol
Exact Mass364.14
IUPAC NameN-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(Oc2cccc(C(F)(F)F)c2)CC1
InChIInChI=1S/C19H19F3N2O2/c20-19(21,22)14-5-4-8-17(13-14)26-16-9-11-24(12-10-16)18(25)23-15-6-2-1-3-7-15/h1-8,13,16H,9-12H2,(H,23,25)
InChIKeyTUVQWDAMBHZWCE-UHFFFAOYSA-N
XLogP4.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.37
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(benzylcarbamoyl)phenyl]-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide
CID 145485865
2-amino-1-[4-[3-(trifluoromethyl)phenoxy]piperidin-1-yl]ethanone
CID 66591548
4-hydroxy-N-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 4251973
(2R)-2-hydroxy-1-[4-[3-(trifluoromethyl)phenoxy]piperidin-1-yl]propan-1-one
CID 70722941
[3-(trifluoromethyl)phenyl]methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 55320533
4-(2,6-dimethylpyrimidin-4-yl)oxy-N-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 121017939
N-[4-(3-hydroxypropyl)-1,3-thiazol-2-yl]-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide
CID 25052545
N,4-bis[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 162535440
N-[3-(3-hydroxyoxetan-3-yl)phenyl]-4-[4-(trifluoromethyl)phenoxy]piperidine-1-carboxamide
CID 164533355
1-cyclobutyloxy-3-(trifluoromethyl)benzene
CID 124519367
3-(benzenesulfonyl)-N-[3-(trifluoromethyl)phenyl]pyrrolidine-1-carboxamide
CID 71805623
5-[4-[3-(trifluoromethyl)phenoxy]piperidine-1-carbonyl]-1H-pyridin-2-one
CID 70750184

Frequently Asked Questions

What is the IUPAC name of N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide?
The IUPAC name of N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide (CID 12999550) is N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide.
What is the SMILES notation for N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide?
The canonical SMILES for N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide is O=C(Nc1ccccc1)N1CCC(Oc2cccc(C(F)(F)F)c2)CC1.
What is the InChIKey of N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide?
The InChIKey is TUVQWDAMBHZWCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N2O2/c20-19(21,22)14-5-4-8-17(13-14)26-16-9-11-24(12-10-16)18(25)23-15-6-2-1-3-7-15/h1-8,13,16H,9-12H2,(H,23,25).
What are the key properties of N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide?
N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide has a molecular weight of 364.37 g/mol, XLogP of 4.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide is sourced from PubChem (CID 12999550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).