(2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide

C13H14ClF3N2O — CID 28951007

IUPAC(2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1C(F)(F)F)[C@H]1CCCCN1
InChIInChI=1S/C13H14ClF3N2O/c14-9-5-3-4-8(13(15,16)17)11(9)19-12(20)10-6-1-2-7-18-10/h3-5,10,18H,1-2,6-7H2,(H,19,20)/t10-/m1/s1
InChIKeyUUDOGNUEFCQTKX-SNVBAGLBSA-N
MW306.71 g/mol
LogP3.44
Rot. Bonds2

About (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide

(2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide (PubChem CID 28951007) has the molecular formula C13H14ClF3N2O and a molecular weight of 306.71 g/mol. Its IUPAC name is (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide
PubChem CID28951007
Molecular FormulaC13H14ClF3N2O
Molecular Weight306.71 g/mol
Exact Mass306.07
IUPAC Name(2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1C(F)(F)F)[C@H]1CCCCN1
InChIInChI=1S/C13H14ClF3N2O/c14-9-5-3-4-8(13(15,16)17)11(9)19-12(20)10-6-1-2-7-18-10/h3-5,10,18H,1-2,6-7H2,(H,19,20)/t10-/m1/s1
InChIKeyUUDOGNUEFCQTKX-SNVBAGLBSA-N
XLogP3.44
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.71
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(2-chloro-6-methylphenyl)pyrrolidine-2-carboxamide
CID 104901241
(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide
CID 28969312
N-(2,3-dichlorophenyl)azepane-2-carboxamide
CID 64563193
N-(2,6-diethylphenyl)piperidine-2-carboxamide
CID 24706345
N-(2,6-dimethylphenyl)azepane-2-carboxamide
CID 64562214
N-(2,6-difluorophenyl)pyrrolidine-2-carboxamide
CID 43124050
(2S)-N-[3-(trifluoromethyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119671263
(2S)-N-[[2-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride
CID 119705503
(2S)-N-(4-bromo-2,6-dichlorophenyl)piperidine-2-carboxamide
CID 28993479
N-(2-chloro-4,6-difluorophenyl)piperidine-2-carboxamide
CID 83087927
(2S)-N-[3-chloro-2-(dimethylamino)phenyl]piperidine-2-carboxamide
CID 93265591
(2R)-N-[4-bromo-2-(trifluoromethyl)phenyl]piperidine-2-carboxamide
CID 104913181

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide?
The IUPAC name of (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide (CID 28951007) is (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide is O=C(Nc1c(Cl)cccc1C(F)(F)F)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide?
The InChIKey is UUDOGNUEFCQTKX-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H14ClF3N2O/c14-9-5-3-4-8(13(15,16)17)11(9)19-12(20)10-6-1-2-7-18-10/h3-5,10,18H,1-2,6-7H2,(H,19,20)/t10-/m1/s1.
What are the key properties of (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide?
(2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide has a molecular weight of 306.71 g/mol, XLogP of 3.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-chloro-6-(trifluoromethyl)phenyl]piperidine-2-carboxamide is sourced from PubChem (CID 28951007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).