3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine

C19H16F3N3O — CID 137499071

IUPAC3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine
SMILESCOc1ccccc1-c1cccnc1Nc1ccc(CC(F)(F)F)nc1
InChIInChI=1S/C19H16F3N3O/c1-26-17-7-3-2-5-15(17)16-6-4-10-23-18(16)25-14-9-8-13(24-12-14)11-19(20,21)22/h2-10,12H,11H2,1H3,(H,23,25)
InChIKeyIENVKDCEUZECKS-UHFFFAOYSA-N
MW359.35 g/mol
LogP5.00
Rot. Bonds5

About 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine

3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine (PubChem CID 137499071) has the molecular formula C19H16F3N3O and a molecular weight of 359.35 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine
PubChem CID137499071
Molecular FormulaC19H16F3N3O
Molecular Weight359.35 g/mol
Exact Mass359.12
IUPAC Name3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine
SMILESCOc1ccccc1-c1cccnc1Nc1ccc(CC(F)(F)F)nc1
InChIInChI=1S/C19H16F3N3O/c1-26-17-7-3-2-5-15(17)16-6-4-10-23-18(16)25-14-9-8-13(24-12-14)11-19(20,21)22/h2-10,12H,11H2,1H3,(H,23,25)
InChIKeyIENVKDCEUZECKS-UHFFFAOYSA-N
XLogP5.00
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.35
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-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

Enitociclib
CID 139593425
6-Ethyl-5-{3-[2-Methoxy-5-(Pyridin-4-Yl)phenyl]prop-1-Yn-1-Yl}pyrimidine-2,4-Diamine
CID 57149549
(3R,4S)-1-[6-(6-methoxypyridin-3-yl)pyrimidin-4-yl]-4-(2,4,5-trifluorophenyl)pyrrolidin-3-amine
CID 24180585
4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(2-methoxyphenyl)pyridin-2-amine
CID 44521019
4-(5,6-Dimethyl-2-pyridin-2-yl-pyridin-3-yl)oxy-N-(4-methoxyphenyl)pyridin-2-amine
CID 44521023
Pyrazine-Pyridine Biheteroaryl 15
CID 5330360
4-(5,6-Dimethyl-2-pyridin-2-yl-pyridin-3-yl)oxy-N-(4-fluorophenyl)pyridin-2-amine
CID 44521026
6-({[5-({[2-(3-Fluorophenyl)ethyl]amino}methyl)pyridin-3-Yl]oxy}methyl)-4-Methylpyridin-2-Amine
CID 71627414
US9670161, 1 5-Fluoro-4-(4-fluoro-2-methoxyphenyl)-N-{4-[(methylsulfonyl)methyl]pyridin-2-yl}pyridin-2-amine
CID 73508010
N~3~-[3-(5-Methoxypyridin-3-YL)benzyl]pyridine-2,3-diamine
CID 11500493
cis-1-(4-(3-Methoxyphenyl)cyclohexyl)-4-(pyridin-2-yl)piperazine
CID 10020855
cis-1-(4-(2-Methoxyphenyl)cyclohexyl)-4-(pyridin-2-yl)piperazine
CID 10871856

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine?
The IUPAC name of 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine (CID 137499071) is 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine.
What is the SMILES notation for 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine?
The canonical SMILES for 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine is COc1ccccc1-c1cccnc1Nc1ccc(CC(F)(F)F)nc1.
What is the InChIKey of 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine?
The InChIKey is IENVKDCEUZECKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F3N3O/c1-26-17-7-3-2-5-15(17)16-6-4-10-23-18(16)25-14-9-8-13(24-12-14)11-19(20,21)22/h2-10,12H,11H2,1H3,(H,23,25).
What are the key properties of 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine?
3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine has a molecular weight of 359.35 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-N-[6-(2,2,2-trifluoroethyl)-3-pyridinyl]pyridin-2-amine is sourced from PubChem (CID 137499071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).