2-(trifluoromethyl)quinolin-8-amine

C10H7F3N2 — CID 129451588

IUPAC2-(trifluoromethyl)quinolin-8-amine
SMILESNc1cccc2ccc(C(F)(F)F)nc12
InChIInChI=1S/C10H7F3N2/c11-10(12,13)8-5-4-6-2-1-3-7(14)9(6)15-8/h1-5H,14H2
InChIKeyMVRQURRTFKWFET-UHFFFAOYSA-N
MW212.17 g/mol
LogP2.84
Rot. Bonds

About 2-(trifluoromethyl)quinolin-8-amine

2-(trifluoromethyl)quinolin-8-amine (PubChem CID 129451588) has the molecular formula C10H7F3N2 and a molecular weight of 212.17 g/mol. Its IUPAC name is 2-(trifluoromethyl)quinolin-8-amine.

Molecular Properties

Compound Name2-(trifluoromethyl)quinolin-8-amine
PubChem CID129451588
Molecular FormulaC10H7F3N2
Molecular Weight212.17 g/mol
Exact Mass212.06
IUPAC Name2-(trifluoromethyl)quinolin-8-amine
SMILESNc1cccc2ccc(C(F)(F)F)nc12
InChIInChI=1S/C10H7F3N2/c11-10(12,13)8-5-4-6-2-1-3-7(14)9(6)15-8/h1-5H,14H2
InChIKeyMVRQURRTFKWFET-UHFFFAOYSA-N
XLogP2.84
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.17
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)quinolin-8-amine?
The IUPAC name of 2-(trifluoromethyl)quinolin-8-amine (CID 129451588) is 2-(trifluoromethyl)quinolin-8-amine.
What is the SMILES notation for 2-(trifluoromethyl)quinolin-8-amine?
The canonical SMILES for 2-(trifluoromethyl)quinolin-8-amine is Nc1cccc2ccc(C(F)(F)F)nc12.
What is the InChIKey of 2-(trifluoromethyl)quinolin-8-amine?
The InChIKey is MVRQURRTFKWFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2/c11-10(12,13)8-5-4-6-2-1-3-7(14)9(6)15-8/h1-5H,14H2.
What are the key properties of 2-(trifluoromethyl)quinolin-8-amine?
2-(trifluoromethyl)quinolin-8-amine has a molecular weight of 212.17 g/mol, XLogP of 2.84, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)quinolin-8-amine is sourced from PubChem (CID 129451588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).