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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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).