[2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine

C15H16FNO2 — CID 102980112

IUPAC[2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine
SMILESCOc1ccc(CN)c(Oc2cc(F)ccc2C)c1
InChIInChI=1S/C15H16FNO2/c1-10-3-5-12(16)7-14(10)19-15-8-13(18-2)6-4-11(15)9-17/h3-8H,9,17H2,1-2H3
InChIKeyYPIFKUBDDLGELJ-UHFFFAOYSA-N
MW261.30 g/mol
LogP3.39
Rot. Bonds4

About [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine

[2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine (PubChem CID 102980112) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine.

Molecular Properties

Compound Name[2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine
PubChem CID102980112
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name[2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine
SMILESCOc1ccc(CN)c(Oc2cc(F)ccc2C)c1
InChIInChI=1S/C15H16FNO2/c1-10-3-5-12(16)7-14(10)19-15-8-13(18-2)6-4-11(15)9-17/h3-8H,9,17H2,1-2H3
InChIKeyYPIFKUBDDLGELJ-UHFFFAOYSA-N
XLogP3.39
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3,5-difluorophenoxy)-4-methoxyphenyl]methanamine
CID 81299926
2-(5-fluoro-2-methylphenoxy)-5-methoxyaniline
CID 102980202
[2-(4-fluorophenoxy)-4-methylphenyl]methanamine
CID 62306766
[4-methoxy-2-[(2-methyl-3-pyridinyl)oxy]phenyl]methanamine
CID 81300033
[2-(2,5-dimethylphenoxy)-4-methylphenyl]methanamine
CID 62308844
[2-(4-chloro-3-methylphenoxy)-4-methoxyphenyl]methanamine
CID 81299924
[2-[(2-bromo-4-fluorophenyl)methoxy]-4-methoxyphenyl]methanamine
CID 61267594
2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine
CID 102990405
1-(2,4-dimethoxyphenyl)-N-[(5-fluoro-2-methylphenyl)methyl]methanamine
CID 115967968
[2-bromo-4-(5-fluoro-2-methylphenoxy)phenyl]methanol
CID 114060424
1-bromo-2-[(5-fluoro-2-methylphenoxy)methyl]-4-methoxybenzene
CID 102983162
[2-(3,5-dimethoxyphenoxy)-5-fluorophenyl]methanamine
CID 43589964

Frequently Asked Questions

What is the IUPAC name of [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine?
The IUPAC name of [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine (CID 102980112) is [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine.
What is the SMILES notation for [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine?
The canonical SMILES for [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine is COc1ccc(CN)c(Oc2cc(F)ccc2C)c1.
What is the InChIKey of [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine?
The InChIKey is YPIFKUBDDLGELJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c1-10-3-5-12(16)7-14(10)19-15-8-13(18-2)6-4-11(15)9-17/h3-8H,9,17H2,1-2H3.
What are the key properties of [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine?
[2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine has a molecular weight of 261.30 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-fluoro-2-methylphenoxy)-4-methoxyphenyl]methanamine is sourced from PubChem (CID 102980112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).