5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine

C13H11F3N2O — CID 139370325

IUPAC5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine
SMILESCOc1ccccc1-c1cnc(N)c(C(F)(F)F)c1
InChIInChI=1S/C13H11F3N2O/c1-19-11-5-3-2-4-9(11)8-6-10(13(14,15)16)12(17)18-7-8/h2-7H,1H3,(H2,17,18)
InChIKeyPFDBZFUHKHDVBB-UHFFFAOYSA-N
MW268.24 g/mol
LogP3.36
Rot. Bonds2

About 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine

5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine (PubChem CID 139370325) has the molecular formula C13H11F3N2O and a molecular weight of 268.24 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine
PubChem CID139370325
Molecular FormulaC13H11F3N2O
Molecular Weight268.24 g/mol
Exact Mass268.08
IUPAC Name5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine
SMILESCOc1ccccc1-c1cnc(N)c(C(F)(F)F)c1
InChIInChI=1S/C13H11F3N2O/c1-19-11-5-3-2-4-9(11)8-6-10(13(14,15)16)12(17)18-7-8/h2-7H,1H3,(H2,17,18)
InChIKeyPFDBZFUHKHDVBB-UHFFFAOYSA-N
XLogP3.36
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.24
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)pyridin-2-amine
CID 119015031
[2-amino-5-(2-methoxyphenyl)-3-pyridinyl]methanol
CID 115037715
2-amino-5-(2-methoxyphenyl)pyridine-3-carbaldehyde
CID 115036600
3-(2-methoxyphenyl)-5-[3-(trifluoromethyl)phenyl]pyridin-2-amine
CID 155555120
2-amino-5-(2-methoxyphenyl)pyridine-3-carboxylic acid
CID 53222773
8-methoxy-4-(trifluoromethyl)isoquinolin-1-amine
CID 115063137
5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine
CID 83170169
3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenyl]pyridin-2-amine
CID 119002862
4-methoxy-5-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]pyridine
CID 134628438
5-[2-(2-imidazol-1-ylethyl)phenyl]-3-(trifluoromethyl)pyridin-2-amine
CID 141181695
3-chloro-2-methoxy-5-[2-(trifluoromethoxy)phenyl]pyridine
CID 134625989
2-[4-[6-amino-5-(trifluoromethyl)-3-pyridinyl]-3-fluorophenyl]-N-tert-butylbenzenesulfonamide;methane
CID 159683327

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine (CID 139370325) is 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine is COc1ccccc1-c1cnc(N)c(C(F)(F)F)c1.
What is the InChIKey of 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine?
The InChIKey is PFDBZFUHKHDVBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N2O/c1-19-11-5-3-2-4-9(11)8-6-10(13(14,15)16)12(17)18-7-8/h2-7H,1H3,(H2,17,18).
What are the key properties of 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine?
5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine has a molecular weight of 268.24 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-3-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 139370325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).