5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine

C13H11F3N2O — CID 155344405

IUPAC5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine
SMILESCc1cnc(N)cc1Oc1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H11F3N2O/c1-8-7-18-12(17)6-11(8)19-10-4-2-3-9(5-10)13(14,15)16/h2-7H,1H3,(H2,17,18)
InChIKeyPBBPTZXHFCYBRK-UHFFFAOYSA-N
MW268.24 g/mol
LogP3.78
Rot. Bonds2

About 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine

5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine (PubChem CID 155344405) has the molecular formula C13H11F3N2O and a molecular weight of 268.24 g/mol. Its IUPAC name is 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine.

Molecular Properties

Compound Name5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine
PubChem CID155344405
Molecular FormulaC13H11F3N2O
Molecular Weight268.24 g/mol
Exact Mass268.08
IUPAC Name5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine
SMILESCc1cnc(N)cc1Oc1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H11F3N2O/c1-8-7-18-12(17)6-11(8)19-10-4-2-3-9(5-10)13(14,15)16/h2-7H,1H3,(H2,17,18)
InChIKeyPBBPTZXHFCYBRK-UHFFFAOYSA-N
XLogP3.78
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 ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]isoquinolin-8-amine
CID 69439162
4-methyl-5-[3-(trifluoromethyl)phenoxy]quinoline
CID 151866789
6-[3-(trifluoromethyl)phenoxy]pyridazin-3-amine
CID 14294275
4-methyl-6-[3-(trifluoromethyl)phenoxy]pyrimidin-2-amine
CID 14724234
4-[3-(trifluoromethyl)phenoxy]aniline
CID 2760750
5-[3-(trifluoromethyl)phenoxy]benzene-1,3-diamine
CID 126478251
4,6-bis[3-(trifluoromethyl)phenoxy]pyrimidine
CID 11516885
5-iodo-2-[3-(trifluoromethyl)phenoxy]pyrimidine
CID 13336606
5-(3-tert-butylphenoxy)pyridin-2-amine
CID 43351773
4-(trifluoromethyl)-2-[3-(trifluoromethyl)phenoxy]phenol
CID 54042030
[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine
CID 19627404
5-amino-6-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid
CID 81446828

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine?
The IUPAC name of 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine (CID 155344405) is 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine.
What is the SMILES notation for 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine?
The canonical SMILES for 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine is Cc1cnc(N)cc1Oc1cccc(C(F)(F)F)c1.
What is the InChIKey of 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine?
The InChIKey is PBBPTZXHFCYBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N2O/c1-8-7-18-12(17)6-11(8)19-10-4-2-3-9(5-10)13(14,15)16/h2-7H,1H3,(H2,17,18).
What are the key properties of 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine?
5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine has a molecular weight of 268.24 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-[3-(trifluoromethyl)phenoxy]pyridin-2-amine is sourced from PubChem (CID 155344405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).