4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine

C13H13FN2O — CID 113368178

IUPAC4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine
SMILESCNc1cc(Oc2ccc(F)cc2C)ccn1
InChIInChI=1S/C13H13FN2O/c1-9-7-10(14)3-4-12(9)17-11-5-6-16-13(8-11)15-2/h3-8H,1-2H3,(H,15,16)
InChIKeySVRONSTUXZJSIT-UHFFFAOYSA-N
MW232.26 g/mol
LogP3.36
Rot. Bonds3

About 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine

4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine (PubChem CID 113368178) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine
PubChem CID113368178
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC Name4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine
SMILESCNc1cc(Oc2ccc(F)cc2C)ccn1
InChIInChI=1S/C13H13FN2O/c1-9-7-10(14)3-4-12(9)17-11-5-6-16-13(8-11)15-2/h3-8H,1-2H3,(H,15,16)
InChIKeySVRONSTUXZJSIT-UHFFFAOYSA-N
XLogP3.36
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-amino-2-fluorophenoxy)-N-methylpyridin-2-amine
CID 67252307
4-[3-bromo-4-(trifluoromethoxy)phenoxy]-N-methylpyridin-2-amine
CID 102715111
6-(4-fluoro-2-methylphenoxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720071
4-(5-fluoro-2-methylphenoxy)pyridine-2-carbonitrile
CID 102981648
1-[4-(2,4-difluorophenoxy)-2-pyridinyl]-N-methylmethanamine
CID 55058981
2-(4-fluoro-2-methylphenoxy)pyrimidin-4-amine
CID 116797992
4-(2,3-dihydro-1H-inden-5-yloxy)-N-methylpyridin-2-amine
CID 113368109
4-(2-chloro-3-fluoro-4-methylphenoxy)-N-pyridin-2-ylpyridin-2-amine
CID 170746530
3-(4-fluoro-2-methylphenoxy)-1H-pyrazin-2-one
CID 103241890
4-fluoro-2-methyl-1-(2-methylphenoxy)benzene
CID 69045546
N-(4-fluoro-2-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62144375
1-[4-(2-fluorophenoxy)-2-pyridinyl]-3-methylurea
CID 155512123

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine?
The IUPAC name of 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine (CID 113368178) is 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine.
What is the SMILES notation for 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine?
The canonical SMILES for 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine is CNc1cc(Oc2ccc(F)cc2C)ccn1.
What is the InChIKey of 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine?
The InChIKey is SVRONSTUXZJSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c1-9-7-10(14)3-4-12(9)17-11-5-6-16-13(8-11)15-2/h3-8H,1-2H3,(H,15,16).
What are the key properties of 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine?
4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine has a molecular weight of 232.26 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluoro-2-methylphenoxy)-N-methylpyridin-2-amine is sourced from PubChem (CID 113368178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).