N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine

C15H15F3N2O — CID 104536494

IUPACN-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine
SMILESCCCNc1cncc(Oc2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C15H15F3N2O/c1-2-6-20-12-8-14(10-19-9-12)21-13-5-3-4-11(7-13)15(16,17)18/h3-5,7-10,20H,2,6H2,1H3
InChIKeyGJQPHFMHYLAURY-UHFFFAOYSA-N
MW296.29 g/mol
LogP4.71
Rot. Bonds5

About N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine

N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine (PubChem CID 104536494) has the molecular formula C15H15F3N2O and a molecular weight of 296.29 g/mol. Its IUPAC name is N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine.

Molecular Properties

Compound NameN-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine
PubChem CID104536494
Molecular FormulaC15H15F3N2O
Molecular Weight296.29 g/mol
Exact Mass296.11
IUPAC NameN-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine
SMILESCCCNc1cncc(Oc2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C15H15F3N2O/c1-2-6-20-12-8-14(10-19-9-12)21-13-5-3-4-11(7-13)15(16,17)18/h3-5,7-10,20H,2,6H2,1H3
InChIKeyGJQPHFMHYLAURY-UHFFFAOYSA-N
XLogP4.71
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-tert-butylphenoxy)-N-propylpyridin-3-amine
CID 104536558
3-N-propyl-5-N-[3-(trifluoromethyl)phenyl]pyridine-3,5-diamine
CID 104532313
5-(2,3-dimethylphenoxy)-N-propylpyridin-3-amine
CID 104536354
5-[(5-bromo-3-pyridinyl)oxy]-N-propylpyridin-3-amine
CID 104536852
5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine
CID 104536489
5-(propylamino)-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109223100
N-ethyl-5-(3-iodophenoxy)pyridin-3-amine
CID 104536529
N-propyl-5-quinolin-5-yloxypyridin-3-amine
CID 103046193
2-fluoro-6-[[5-(propylamino)-3-pyridinyl]oxy]benzonitrile
CID 104536574
5-(1-propan-2-ylpyrazol-4-yl)oxy-N-propylpyridin-3-amine
CID 116806496
5-butoxy-N-propylpyridin-3-amine
CID 104536219
5-N-propyl-3-N-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-3,5-diamine
CID 112938432

Frequently Asked Questions

What is the IUPAC name of N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine?
The IUPAC name of N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine (CID 104536494) is N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine.
What is the SMILES notation for N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine?
The canonical SMILES for N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine is CCCNc1cncc(Oc2cccc(C(F)(F)F)c2)c1.
What is the InChIKey of N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine?
The InChIKey is GJQPHFMHYLAURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2O/c1-2-6-20-12-8-14(10-19-9-12)21-13-5-3-4-11(7-13)15(16,17)18/h3-5,7-10,20H,2,6H2,1H3.
What are the key properties of N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine?
N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine has a molecular weight of 296.29 g/mol, XLogP of 4.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine is sourced from PubChem (CID 104536494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).