2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline

C14H14F3N3 — CID 4992006

IUPAC2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline
SMILESFC(F)(F)c1nc2ccccc2nc1N1CCCCC1
InChIInChI=1S/C14H14F3N3/c15-14(16,17)12-13(20-8-4-1-5-9-20)19-11-7-3-2-6-10(11)18-12/h2-3,6-7H,1,4-5,8-9H2
InChIKeyGGQUZNXTKOKQPI-UHFFFAOYSA-N
MW281.28 g/mol
LogP3.64
Rot. Bonds1

About 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline

2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline (PubChem CID 4992006) has the molecular formula C14H14F3N3 and a molecular weight of 281.28 g/mol. Its IUPAC name is 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline.

Molecular Properties

Compound Name2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline
PubChem CID4992006
Molecular FormulaC14H14F3N3
Molecular Weight281.28 g/mol
Exact Mass281.11
IUPAC Name2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline
SMILESFC(F)(F)c1nc2ccccc2nc1N1CCCCC1
InChIInChI=1S/C14H14F3N3/c15-14(16,17)12-13(20-8-4-1-5-9-20)19-11-7-3-2-6-10(11)18-12/h2-3,6-7H,1,4-5,8-9H2
InChIKeyGGQUZNXTKOKQPI-UHFFFAOYSA-N
XLogP3.64
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-(trifluoromethyl)quinoxaline
CID 22331907
4-piperidin-1-yl-2-[4-(trifluoromethyl)phenyl]quinazoline
CID 25129008
4-(azepan-1-yl)quinazolin-2-amine
CID 80764088
(3S)-N-(4-acetamidophenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-3-carboxamide
CID 93065217
(3S)-N-(2-chlorophenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-3-carboxamide
CID 93065192
4-pyrrolidin-1-ylquinazolin-2-amine
CID 57342786
(3-piperidin-1-ylquinoxalin-2-yl)hydrazine
CID 51345740
N-(4-chlorophenyl)-4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carboxamide
CID 53052187
2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(trifluoromethyl)quinoxaline
CID 53052250
(3R)-N-(3-fluorophenyl)-1-[3-(trifluoromethyl)quinoxalin-2-yl]piperidine-3-carboxamide
CID 93065205
2-[4-(5-fluoro-2-methylphenyl)sulfonylpiperazin-1-yl]-3-(trifluoromethyl)quinoxaline
CID 53052264
4-(azepan-1-yl)-2-(4-tert-butylphenyl)quinazoline
CID 23852302

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline?
The IUPAC name of 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline (CID 4992006) is 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline.
What is the SMILES notation for 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline?
The canonical SMILES for 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline is FC(F)(F)c1nc2ccccc2nc1N1CCCCC1.
What is the InChIKey of 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline?
The InChIKey is GGQUZNXTKOKQPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3/c15-14(16,17)12-13(20-8-4-1-5-9-20)19-11-7-3-2-6-10(11)18-12/h2-3,6-7H,1,4-5,8-9H2.
What are the key properties of 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline?
2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline has a molecular weight of 281.28 g/mol, XLogP of 3.64, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline is sourced from PubChem (CID 4992006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).