[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol

C15H16FNO2 — CID 105383279

IUPAC[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol
SMILESCc1cc(C)c(C)c(Oc2nccc(CO)c2F)c1
InChIInChI=1S/C15H16FNO2/c1-9-6-10(2)11(3)13(7-9)19-15-14(16)12(8-18)4-5-17-15/h4-7,18H,8H2,1-3H3
InChIKeyIKAIGTCFKCLGAN-UHFFFAOYSA-N
MW261.30 g/mol
LogP3.43
Rot. Bonds3

About [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol

[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol (PubChem CID 105383279) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol
PubChem CID105383279
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol
SMILESCc1cc(C)c(C)c(Oc2nccc(CO)c2F)c1
InChIInChI=1S/C15H16FNO2/c1-9-6-10(2)11(3)13(7-9)19-15-14(16)12(8-18)4-5-17-15/h4-7,18H,8H2,1-3H3
InChIKeyIKAIGTCFKCLGAN-UHFFFAOYSA-N
XLogP3.43
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol
CID 105383255
[2-(2-chlorophenoxy)-3-fluoro-4-pyridinyl]methanol
CID 105383259
[3-fluoro-2-[2-(trifluoromethyl)phenoxy]-4-pyridinyl]methanol
CID 105383241
[3-fluoro-2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanol
CID 105383273
3-(bromomethyl)-2-(2,3,5-trimethylphenoxy)pyridine
CID 114057025
[2-(2-butan-2-ylphenoxy)-3-fluoro-4-pyridinyl]methanol
CID 105383274
[5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol
CID 61256314
[2-(2-chloro-4-methylphenoxy)-3-fluoro-4-pyridinyl]methanamine
CID 105391433
3-(2,3,5-trimethylphenoxy)pyrazine-2-carboxylic acid
CID 55107953
4-(chloromethyl)-3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)pyridine
CID 105383793
N-[[3-fluoro-2-(2-methylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105391185
[2-(2-bromo-4-methylphenoxy)-3-fluoro-4-pyridinyl]methanamine
CID 105391301

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol?
The IUPAC name of [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol (CID 105383279) is [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol.
What is the SMILES notation for [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol?
The canonical SMILES for [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol is Cc1cc(C)c(C)c(Oc2nccc(CO)c2F)c1.
What is the InChIKey of [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol?
The InChIKey is IKAIGTCFKCLGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c1-9-6-10(2)11(3)13(7-9)19-15-14(16)12(8-18)4-5-17-15/h4-7,18H,8H2,1-3H3.
What are the key properties of [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol?
[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol has a molecular weight of 261.30 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol is sourced from PubChem (CID 105383279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).