5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline

C11H7F3N4 — CID 70990023

IUPAC5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline
SMILESCc1cc2nnnn2c2cc(C(F)(F)F)ccc12
InChIInChI=1S/C11H7F3N4/c1-6-4-10-15-16-17-18(10)9-5-7(11(12,13)14)2-3-8(6)9/h2-5H,1H3
InChIKeyFFTXSBMKFJGYOO-UHFFFAOYSA-N
MW252.20 g/mol
LogP2.60
Rot. Bonds

About 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline

5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline (PubChem CID 70990023) has the molecular formula C11H7F3N4 and a molecular weight of 252.20 g/mol. Its IUPAC name is 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline.

Molecular Properties

Compound Name5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline
PubChem CID70990023
Molecular FormulaC11H7F3N4
Molecular Weight252.20 g/mol
Exact Mass252.06
IUPAC Name5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline
SMILESCc1cc2nnnn2c2cc(C(F)(F)F)ccc12
InChIInChI=1S/C11H7F3N4/c1-6-4-10-15-16-17-18(10)9-5-7(11(12,13)14)2-3-8(6)9/h2-5H,1H3
InChIKeyFFTXSBMKFJGYOO-UHFFFAOYSA-N
XLogP2.60
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.20
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline 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 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline?
The IUPAC name of 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline (CID 70990023) is 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline.
What is the SMILES notation for 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline?
The canonical SMILES for 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline is Cc1cc2nnnn2c2cc(C(F)(F)F)ccc12.
What is the InChIKey of 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline?
The InChIKey is FFTXSBMKFJGYOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F3N4/c1-6-4-10-15-16-17-18(10)9-5-7(11(12,13)14)2-3-8(6)9/h2-5H,1H3.
What are the key properties of 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline?
5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline has a molecular weight of 252.20 g/mol, XLogP of 2.60, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-8-(trifluoromethyl)tetrazolo[1,5-a]quinoline is sourced from PubChem (CID 70990023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).