N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide

C14H16F4N2O — CID 63047528

IUPACN-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide
SMILESO=C(CC1CCCCN1)Nc1cc(C(F)(F)F)ccc1F
InChIInChI=1S/C14H16F4N2O/c15-11-5-4-9(14(16,17)18)7-12(11)20-13(21)8-10-3-1-2-6-19-10/h4-5,7,10,19H,1-3,6,8H2,(H,20,21)
InChIKeyOWWLHLMLUFSCTG-UHFFFAOYSA-N
MW304.29 g/mol
LogP3.32
Rot. Bonds3

About N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide

N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide (PubChem CID 63047528) has the molecular formula C14H16F4N2O and a molecular weight of 304.29 g/mol. Its IUPAC name is N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide.

Molecular Properties

Compound NameN-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide
PubChem CID63047528
Molecular FormulaC14H16F4N2O
Molecular Weight304.29 g/mol
Exact Mass304.12
IUPAC NameN-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide
SMILESO=C(CC1CCCCN1)Nc1cc(C(F)(F)F)ccc1F
InChIInChI=1S/C14H16F4N2O/c15-11-5-4-9(14(16,17)18)7-12(11)20-13(21)8-10-3-1-2-6-19-10/h4-5,7,10,19H,1-3,6,8H2,(H,20,21)
InChIKeyOWWLHLMLUFSCTG-UHFFFAOYSA-N
XLogP3.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.29
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[2-fluoro-5-(trifluoromethyl)phenyl]piperidine-2-carboxamide
CID 103808490
N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119828255
N-(3-acetamido-4-fluorophenyl)-2-pyrrolidin-2-ylacetamide
CID 61364257
N-(5-bromo-2,4-difluorophenyl)-2-pyrrolidin-2-ylacetamide
CID 102853687
N-[2-fluoro-5-(trifluoromethyl)phenyl]cyclohexanecarboxamide
CID 2224325
3-[2-fluoro-5-(trifluoromethyl)anilino]-3-oxopropanoic acid
CID 63049503
N-[5-fluoro-2-(2,2,2-trifluoroethoxy)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119702559
N-(2-bromo-5-chlorophenyl)-2-pyrrolidin-2-ylacetamide
CID 81270551
N-(2,5-difluorophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635385
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-thiomorpholin-3-ylacetamide
CID 66422398
5-chloro-2-[(2-pyrrolidin-2-ylacetyl)amino]benzoic acid
CID 61365655
2-pyrrolidin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]acetamide
CID 61366605

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide?
The IUPAC name of N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide (CID 63047528) is N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide.
What is the SMILES notation for N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide?
The canonical SMILES for N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide is O=C(CC1CCCCN1)Nc1cc(C(F)(F)F)ccc1F.
What is the InChIKey of N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide?
The InChIKey is OWWLHLMLUFSCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F4N2O/c15-11-5-4-9(14(16,17)18)7-12(11)20-13(21)8-10-3-1-2-6-19-10/h4-5,7,10,19H,1-3,6,8H2,(H,20,21).
What are the key properties of N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide?
N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide has a molecular weight of 304.29 g/mol, XLogP of 3.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-5-(trifluoromethyl)phenyl]-2-piperidin-2-ylacetamide is sourced from PubChem (CID 63047528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).