(5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine

C13H11F3N2O — CID 105026146

IUPAC(5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine
SMILESCOc1cncc(C(N)c2c(F)cc(F)cc2F)c1
InChIInChI=1S/C13H11F3N2O/c1-19-9-2-7(5-18-6-9)13(17)12-10(15)3-8(14)4-11(12)16/h2-6,13H,17H2,1H3
InChIKeyNKFPSICMMAMKEI-UHFFFAOYSA-N
MW268.24 g/mol
LogP2.56
Rot. Bonds3

About (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine

(5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine (PubChem CID 105026146) has the molecular formula C13H11F3N2O and a molecular weight of 268.24 g/mol. Its IUPAC name is (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine.

Molecular Properties

Compound Name(5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine
PubChem CID105026146
Molecular FormulaC13H11F3N2O
Molecular Weight268.24 g/mol
Exact Mass268.08
IUPAC Name(5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine
SMILESCOc1cncc(C(N)c2c(F)cc(F)cc2F)c1
InChIInChI=1S/C13H11F3N2O/c1-19-9-2-7(5-18-6-9)13(17)12-10(15)3-8(14)4-11(12)16/h2-6,13H,17H2,1H3
InChIKeyNKFPSICMMAMKEI-UHFFFAOYSA-N
XLogP2.56
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.24
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine 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

(3-fluoro-4-methoxyphenyl)-(5-methoxy-3-pyridinyl)methanamine
CID 105026161
(5-methoxy-3-pyridinyl)-(5-methylthiophen-2-yl)methanamine
CID 105026193
(5-fluoro-3-pyridinyl)-(5-methoxy-3-pyridinyl)methanol
CID 105121302
(4-bromo-3,5-dimethylphenyl)-(5-methoxy-3-pyridinyl)methanamine
CID 114330272
(3,4-dimethylphenyl)-(5-methoxy-3-pyridinyl)methanamine
CID 105025843
(3,5-dimethoxypyrazin-2-yl)-(2,4,6-trifluorophenyl)methanamine
CID 105031257
1-(5-fluoro-3-pyridinyl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105175369
(4-methoxythiophen-2-yl)-(2,4,6-trifluorophenyl)methanamine
CID 81127367
(2,5-dimethylphenyl)-(5-methoxy-3-pyridinyl)methanamine
CID 105025888
3-(dimethoxymethyl)-5-methoxypyridine
CID 45361740
(2,6-difluoro-4-methoxyphenyl)-(4-propan-2-ylphenyl)methanamine
CID 60964329
2,2-difluoro-1-(5-methoxy-3-pyridinyl)ethanol
CID 112575542

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine?
The IUPAC name of (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine (CID 105026146) is (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine.
What is the SMILES notation for (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine?
The canonical SMILES for (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine is COc1cncc(C(N)c2c(F)cc(F)cc2F)c1.
What is the InChIKey of (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine?
The InChIKey is NKFPSICMMAMKEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N2O/c1-19-9-2-7(5-18-6-9)13(17)12-10(15)3-8(14)4-11(12)16/h2-6,13H,17H2,1H3.
What are the key properties of (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine?
(5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine has a molecular weight of 268.24 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-3-pyridinyl)-(2,4,6-trifluorophenyl)methanamine is sourced from PubChem (CID 105026146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).