(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine

C14H10F5N — CID 107288878

IUPAC(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine
SMILESNC(c1ccc(C(F)(F)F)c(F)c1)c1ccccc1F
InChIInChI=1S/C14H10F5N/c15-11-4-2-1-3-9(11)13(20)8-5-6-10(12(16)7-8)14(17,18)19/h1-7,13H,20H2
InChIKeySLCQMIUQTJPIJI-UHFFFAOYSA-N
MW287.23 g/mol
LogP4.03
Rot. Bonds2

About (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine

(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine (PubChem CID 107288878) has the molecular formula C14H10F5N and a molecular weight of 287.23 g/mol. Its IUPAC name is (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine
PubChem CID107288878
Molecular FormulaC14H10F5N
Molecular Weight287.23 g/mol
Exact Mass287.07
IUPAC Name(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine
SMILESNC(c1ccc(C(F)(F)F)c(F)c1)c1ccccc1F
InChIInChI=1S/C14H10F5N/c15-11-4-2-1-3-9(11)13(20)8-5-6-10(12(16)7-8)14(17,18)19/h1-7,13H,20H2
InChIKeySLCQMIUQTJPIJI-UHFFFAOYSA-N
XLogP4.03
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.23
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287213
(4-chlorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine
CID 107288719
(2-chloro-6-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine
CID 107291671
(S)-(4-chlorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 170898786
[3-fluoro-4-(trifluoromethyl)phenyl]-(4-iodophenyl)methanamine
CID 107291498
2-(2-fluorophenyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethanamine
CID 107288822
(2-chlorophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanamine
CID 115801247
(2-tert-butylphenyl)-(3-fluoro-4-methylphenyl)methanamine
CID 107130189
(S)-[3-fluoro-4-(trifluoromethyl)phenyl]-thiophen-3-ylmethanamine;hydrochloride
CID 171209499
(1R)-3,3,3-trifluoro-1-[3-fluoro-4-(trifluoromethyl)phenyl]propan-1-amine
CID 171209484
[3-fluoro-4-(trifluoromethyl)phenyl]-(3-methyl-2-pyridinyl)methanamine
CID 107288835
2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanamine
CID 43115579

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine (CID 107288878) is (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine is NC(c1ccc(C(F)(F)F)c(F)c1)c1ccccc1F.
What is the InChIKey of (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine?
The InChIKey is SLCQMIUQTJPIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F5N/c15-11-4-2-1-3-9(11)13(20)8-5-6-10(12(16)7-8)14(17,18)19/h1-7,13H,20H2.
What are the key properties of (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine?
(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine has a molecular weight of 287.23 g/mol, XLogP of 4.03, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 107288878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).