N-(2,3,4-trifluorophenyl)quinolin-2-amine

C15H9F3N2 — CID 2320272

IUPACN-(2,3,4-trifluorophenyl)quinolin-2-amine
SMILESFc1ccc(Nc2ccc3ccccc3n2)c(F)c1F
InChIInChI=1S/C15H9F3N2/c16-10-6-7-12(15(18)14(10)17)20-13-8-5-9-3-1-2-4-11(9)19-13/h1-8H,(H,19,20)
InChIKeyKQRUOFSGEWQVON-UHFFFAOYSA-N
MW274.25 g/mol
LogP4.40
Rot. Bonds2

About N-(2,3,4-trifluorophenyl)quinolin-2-amine

N-(2,3,4-trifluorophenyl)quinolin-2-amine (PubChem CID 2320272) has the molecular formula C15H9F3N2 and a molecular weight of 274.25 g/mol. Its IUPAC name is N-(2,3,4-trifluorophenyl)quinolin-2-amine.

Molecular Properties

Compound NameN-(2,3,4-trifluorophenyl)quinolin-2-amine
PubChem CID2320272
Molecular FormulaC15H9F3N2
Molecular Weight274.25 g/mol
Exact Mass274.07
IUPAC NameN-(2,3,4-trifluorophenyl)quinolin-2-amine
SMILESFc1ccc(Nc2ccc3ccccc3n2)c(F)c1F
InChIInChI=1S/C15H9F3N2/c16-10-6-7-12(15(18)14(10)17)20-13-8-5-9-3-1-2-4-11(9)19-13/h1-8H,(H,19,20)
InChIKeyKQRUOFSGEWQVON-UHFFFAOYSA-N
XLogP4.40
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

N-(2,5-difluorophenyl)quinolin-2-amine
CID 82536785
2,3,4-trifluoro-N-(quinolin-2-ylmethyl)aniline
CID 28774815
N-(3,4-difluorophenyl)quinolin-2-amine
CID 82536877
N-(5-chloro-2-methylphenyl)quinolin-2-amine
CID 82536306
4-(quinolin-2-ylamino)benzene-1,3-dicarboxylic acid
CID 154113616
N-[2-ethyl-4-(trifluoromethoxy)phenyl]quinolin-2-amine
CID 146295747
N-[2-(1-aminoethyl)phenyl]quinolin-2-amine
CID 63759098
N-(2-nitrophenyl)quinolin-2-amine
CID 54688542
2-quinolin-2-ylsulfanyl-N-(2,3,4-trifluorophenyl)propanamide
CID 17431422
N-[4-(4-fluorophenoxy)phenyl]quinolin-2-amine
CID 146295745
1-(2-fluorophenyl)-3-quinolin-2-ylurea
CID 2812960
[1-oxo-1-(2,3,4-trifluoroanilino)propan-2-yl] quinoline-2-carboxylate
CID 46790445

Frequently Asked Questions

What is the IUPAC name of N-(2,3,4-trifluorophenyl)quinolin-2-amine?
The IUPAC name of N-(2,3,4-trifluorophenyl)quinolin-2-amine (CID 2320272) is N-(2,3,4-trifluorophenyl)quinolin-2-amine.
What is the SMILES notation for N-(2,3,4-trifluorophenyl)quinolin-2-amine?
The canonical SMILES for N-(2,3,4-trifluorophenyl)quinolin-2-amine is Fc1ccc(Nc2ccc3ccccc3n2)c(F)c1F.
What is the InChIKey of N-(2,3,4-trifluorophenyl)quinolin-2-amine?
The InChIKey is KQRUOFSGEWQVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F3N2/c16-10-6-7-12(15(18)14(10)17)20-13-8-5-9-3-1-2-4-11(9)19-13/h1-8H,(H,19,20).
What are the key properties of N-(2,3,4-trifluorophenyl)quinolin-2-amine?
N-(2,3,4-trifluorophenyl)quinolin-2-amine has a molecular weight of 274.25 g/mol, XLogP of 4.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,4-trifluorophenyl)quinolin-2-amine is sourced from PubChem (CID 2320272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).