4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline

C14H13F3N6 — CID 58055693

IUPAC4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline
SMILESFC(F)(F)c1ccc2nc(N3CCCCC3)c3nnnn3c2c1
InChIInChI=1S/C14H13F3N6/c15-14(16,17)9-4-5-10-11(8-9)23-13(19-20-21-23)12(18-10)22-6-2-1-3-7-22/h4-5,8H,1-3,6-7H2
InChIKeyCZPYHSBKSVETDO-UHFFFAOYSA-N
MW322.29 g/mol
LogP2.68
Rot. Bonds1

About 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline

4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline (PubChem CID 58055693) has the molecular formula C14H13F3N6 and a molecular weight of 322.29 g/mol. Its IUPAC name is 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline.

Molecular Properties

Compound Name4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline
PubChem CID58055693
Molecular FormulaC14H13F3N6
Molecular Weight322.29 g/mol
Exact Mass322.12
IUPAC Name4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline
SMILESFC(F)(F)c1ccc2nc(N3CCCCC3)c3nnnn3c2c1
InChIInChI=1S/C14H13F3N6/c15-14(16,17)9-4-5-10-11(8-9)23-13(19-20-21-23)12(18-10)22-6-2-1-3-7-22/h4-5,8H,1-3,6-7H2
InChIKeyCZPYHSBKSVETDO-UHFFFAOYSA-N
XLogP2.68
TPSA59.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.29
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline with MolForge

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Related Compounds

tert-butyl 4-[8-(trifluoromethyl)tetrazolo[1,5-a]quinoxalin-4-yl]piperazine-1-carboxylate
CID 59320644
7-chloro-4-piperazin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline
CID 58475763
4-(tetrazolo[1,5-a]quinoxalin-4-yl)morpholine
CID 5309141
4-[4-(4-fluorophenyl)piperazin-1-yl]tetrazolo[1,5-a]quinoxaline
CID 20889100
8-chloro-7-fluoro-4-piperazin-1-yltetrazolo[1,5-a]quinoxaline;hydrochloride
CID 66686703
2-piperidin-1-yl-3-(trifluoromethyl)quinoxaline
CID 4992006
4-pyridin-3-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline
CID 59696662
8-(trifluoromethyl)-4-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyrrolo[1,2-a]quinoxaline
CID 155406860
1-[8-(trifluoromethyl)pyrrolo[1,2-a]quinoxalin-4-yl]piperidine-3-carboxylic acid
CID 155406462
4-(4-benzylpiperidin-1-yl)tetrazolo[1,5-a]quinoxaline
CID 3241422
8,9-difluoro-4-(4-methylpiperazin-1-yl)tetrazolo[1,5-a]quinoxaline
CID 58476032
6-(trifluoromethyl)benzotriazol-1-amine
CID 123807461

Frequently Asked Questions

What is the IUPAC name of 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline?
The IUPAC name of 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline (CID 58055693) is 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline.
What is the SMILES notation for 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline?
The canonical SMILES for 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline is FC(F)(F)c1ccc2nc(N3CCCCC3)c3nnnn3c2c1.
What is the InChIKey of 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline?
The InChIKey is CZPYHSBKSVETDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N6/c15-14(16,17)9-4-5-10-11(8-9)23-13(19-20-21-23)12(18-10)22-6-2-1-3-7-22/h4-5,8H,1-3,6-7H2.
What are the key properties of 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline?
4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline has a molecular weight of 322.29 g/mol, XLogP of 2.68, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-yl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoxaline is sourced from PubChem (CID 58055693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).