N-ethyl-2-(trifluoromethyl)quinazolin-4-amine

C11H10F3N3 — CID 21003229

IUPACN-ethyl-2-(trifluoromethyl)quinazolin-4-amine
SMILESCCNc1nc(C(F)(F)F)nc2ccccc12
InChIInChI=1S/C11H10F3N3/c1-2-15-9-7-5-3-4-6-8(7)16-10(17-9)11(12,13)14/h3-6H,2H2,1H3,(H,15,16,17)
InChIKeyMFEUZKQFJKVUSL-UHFFFAOYSA-N
MW241.22 g/mol
LogP3.08
Rot. Bonds2

About N-ethyl-2-(trifluoromethyl)quinazolin-4-amine

N-ethyl-2-(trifluoromethyl)quinazolin-4-amine (PubChem CID 21003229) has the molecular formula C11H10F3N3 and a molecular weight of 241.22 g/mol. Its IUPAC name is N-ethyl-2-(trifluoromethyl)quinazolin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(trifluoromethyl)quinazolin-4-amine
PubChem CID21003229
Molecular FormulaC11H10F3N3
Molecular Weight241.22 g/mol
Exact Mass241.08
IUPAC NameN-ethyl-2-(trifluoromethyl)quinazolin-4-amine
SMILESCCNc1nc(C(F)(F)F)nc2ccccc12
InChIInChI=1S/C11H10F3N3/c1-2-15-9-7-5-3-4-6-8(7)16-10(17-9)11(12,13)14/h3-6H,2H2,1H3,(H,15,16,17)
InChIKeyMFEUZKQFJKVUSL-UHFFFAOYSA-N
XLogP3.08
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.22
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(trifluoromethyl)quinazolin-4-amine?
The IUPAC name of N-ethyl-2-(trifluoromethyl)quinazolin-4-amine (CID 21003229) is N-ethyl-2-(trifluoromethyl)quinazolin-4-amine.
What is the SMILES notation for N-ethyl-2-(trifluoromethyl)quinazolin-4-amine?
The canonical SMILES for N-ethyl-2-(trifluoromethyl)quinazolin-4-amine is CCNc1nc(C(F)(F)F)nc2ccccc12.
What is the InChIKey of N-ethyl-2-(trifluoromethyl)quinazolin-4-amine?
The InChIKey is MFEUZKQFJKVUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3/c1-2-15-9-7-5-3-4-6-8(7)16-10(17-9)11(12,13)14/h3-6H,2H2,1H3,(H,15,16,17).
What are the key properties of N-ethyl-2-(trifluoromethyl)quinazolin-4-amine?
N-ethyl-2-(trifluoromethyl)quinazolin-4-amine has a molecular weight of 241.22 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(trifluoromethyl)quinazolin-4-amine is sourced from PubChem (CID 21003229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).