2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine

C13H13FN2O — CID 114051155

IUPAC2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine
SMILESCOc1ccc(-c2nccc(C)c2N)c(F)c1
InChIInChI=1S/C13H13FN2O/c1-8-5-6-16-13(12(8)15)10-4-3-9(17-2)7-11(10)14/h3-7H,15H2,1-2H3
InChIKeyBWFAQRJDDAHZNN-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.79
Rot. Bonds2

About 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine

2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine (PubChem CID 114051155) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine.

Molecular Properties

Compound Name2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine
PubChem CID114051155
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC Name2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine
SMILESCOc1ccc(-c2nccc(C)c2N)c(F)c1
InChIInChI=1S/C13H13FN2O/c1-8-5-6-16-13(12(8)15)10-4-3-9(17-2)7-11(10)14/h3-7H,15H2,1-2H3
InChIKeyBWFAQRJDDAHZNN-UHFFFAOYSA-N
XLogP2.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dimethoxyphenyl)-4-methylpyridin-3-amine
CID 114051131
2-(4-ethyl-2-fluorophenyl)-4-methylpyridin-3-amine
CID 175988062
4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine
CID 115505211
3-(2-fluoro-4-methoxyphenyl)-2-methylpyridine
CID 118448916
(2-amino-4-methyl-3-pyridinyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 81305114
4-(2-fluoro-4-methoxyphenyl)-1-methylpyrazol-3-amine
CID 171382899
6-(2-fluoro-4-methoxyphenyl)-1H-pyrimidine-2-thione
CID 106520926
2-fluoro-4-methoxyaniline
CID 3756383
tert-butyl 4-amino-3-(2-fluoro-4-methoxyphenyl)-5-methylpyrazole-1-carboxylate
CID 42873965
5-(2,4-dimethoxyphenyl)-4-fluoro-2-methylaniline
CID 107593656
2-(4-methoxy-2-methylphenyl)pyrimidin-4-amine
CID 116795272
3-(2-fluoro-4-methoxyphenyl)-4-phenyl-1,2-oxazol-5-amine
CID 102883442

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine?
The IUPAC name of 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine (CID 114051155) is 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine.
What is the SMILES notation for 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine?
The canonical SMILES for 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine is COc1ccc(-c2nccc(C)c2N)c(F)c1.
What is the InChIKey of 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine?
The InChIKey is BWFAQRJDDAHZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c1-8-5-6-16-13(12(8)15)10-4-3-9(17-2)7-11(10)14/h3-7H,15H2,1-2H3.
What are the key properties of 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine?
2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine has a molecular weight of 232.26 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine is sourced from PubChem (CID 114051155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).