6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine

C15H15F3N2O3 — CID 22485528

IUPAC6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine
SMILESCOc1cc(-c2ccc(N)cn2)cc(OC)c1OCC(F)(F)F
InChIInChI=1S/C15H15F3N2O3/c1-21-12-5-9(11-4-3-10(19)7-20-11)6-13(22-2)14(12)23-8-15(16,17)18/h3-7H,8,19H2,1-2H3
InChIKeyLFXYXJDRIXGEIX-UHFFFAOYSA-N
MW328.29 g/mol
LogP3.29
Rot. Bonds5

About 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine

6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine (PubChem CID 22485528) has the molecular formula C15H15F3N2O3 and a molecular weight of 328.29 g/mol. Its IUPAC name is 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine.

Molecular Properties

Compound Name6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine
PubChem CID22485528
Molecular FormulaC15H15F3N2O3
Molecular Weight328.29 g/mol
Exact Mass328.10
IUPAC Name6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine
SMILESCOc1cc(-c2ccc(N)cn2)cc(OC)c1OCC(F)(F)F
InChIInChI=1S/C15H15F3N2O3/c1-21-12-5-9(11-4-3-10(19)7-20-11)6-13(22-2)14(12)23-8-15(16,17)18/h3-7H,8,19H2,1-2H3
InChIKeyLFXYXJDRIXGEIX-UHFFFAOYSA-N
XLogP3.29
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.29
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]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

Related Compounds

Octaverine
CID 68363
1-{4-[5-(3,4,5-Trimethoxyphenyl)pyridin-3-Yl]phenyl}piperazine
CID 71299325
Ldn-214117
CID 91754554
(E)-N-pyridin-3-yl-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
CID 797814
Pyridin-4-ylmethyl-(3,4,5-trimethoxy-benzyl)-amine hydrochloride
CID 24746782
4-[[(5-Ethoxy-2-fluoro-3-propan-2-yloxyphenyl)-pyridin-2-ylmethyl]amino]benzenecarboximidamide
CID 57803704
2,4-Bis(3,4,5-trimethoxyphenyl)pyridine
CID 90670570
US10155760, Example 38
CID 118420284
Pyridine, 3,4-dimethyl-2-((3,4,5-trimethoxyphenyl)methyl)-
CID 3044482
Octaverine Hydrochloride
CID 81240
2-(3,4-dimethoxyphenyl)-N-(pyridin-2-ylmethyl)ethanamine
CID 1618543
3-[2-(4-Fluorophenyl)-3-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazol-5-yl]pyridine
CID 3367461

Frequently Asked Questions

What is the IUPAC name of 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine?
The IUPAC name of 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine (CID 22485528) is 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine.
What is the SMILES notation for 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine?
The canonical SMILES for 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine is COc1cc(-c2ccc(N)cn2)cc(OC)c1OCC(F)(F)F.
What is the InChIKey of 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine?
The InChIKey is LFXYXJDRIXGEIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2O3/c1-21-12-5-9(11-4-3-10(19)7-20-11)6-13(22-2)14(12)23-8-15(16,17)18/h3-7H,8,19H2,1-2H3.
What are the key properties of 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine?
6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine has a molecular weight of 328.29 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3,5-dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]pyridin-3-amine is sourced from PubChem (CID 22485528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).