6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine

C15H15F3N2O — CID 43093893

IUPAC6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine
SMILESCOc1ccc(NC(C)c2ccccc2C(F)(F)F)cn1
InChIInChI=1S/C15H15F3N2O/c1-10(20-11-7-8-14(21-2)19-9-11)12-5-3-4-6-13(12)15(16,17)18/h3-10,20H,1-2H3
InChIKeyWCNASWDUVUQYLH-UHFFFAOYSA-N
MW296.29 g/mol
LogP4.28
Rot. Bonds4

About 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine

6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine (PubChem CID 43093893) has the molecular formula C15H15F3N2O and a molecular weight of 296.29 g/mol. Its IUPAC name is 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine.

Molecular Properties

Compound Name6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine
PubChem CID43093893
Molecular FormulaC15H15F3N2O
Molecular Weight296.29 g/mol
Exact Mass296.11
IUPAC Name6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine
SMILESCOc1ccc(NC(C)c2ccccc2C(F)(F)F)cn1
InChIInChI=1S/C15H15F3N2O/c1-10(20-11-7-8-14(21-2)19-9-11)12-5-3-4-6-13(12)15(16,17)18/h3-10,20H,1-2H3
InChIKeyWCNASWDUVUQYLH-UHFFFAOYSA-N
XLogP4.28
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
The IUPAC name of 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine (CID 43093893) is 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine.
What is the SMILES notation for 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
The canonical SMILES for 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine is COc1ccc(NC(C)c2ccccc2C(F)(F)F)cn1.
What is the InChIKey of 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
The InChIKey is WCNASWDUVUQYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2O/c1-10(20-11-7-8-14(21-2)19-9-11)12-5-3-4-6-13(12)15(16,17)18/h3-10,20H,1-2H3.
What are the key properties of 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine has a molecular weight of 296.29 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine is sourced from PubChem (CID 43093893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).