[3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol

C16H18FNO2 — CID 105383255

IUPAC[3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol
SMILESCc1ccc(C(C)C)c(Oc2nccc(CO)c2F)c1
InChIInChI=1S/C16H18FNO2/c1-10(2)13-5-4-11(3)8-14(13)20-16-15(17)12(9-19)6-7-18-16/h4-8,10,19H,9H2,1-3H3
InChIKeySXNYUUKDJULUJJ-UHFFFAOYSA-N
MW275.32 g/mol
LogP3.94
Rot. Bonds4

About [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol

[3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol (PubChem CID 105383255) has the molecular formula C16H18FNO2 and a molecular weight of 275.32 g/mol. Its IUPAC name is [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol
PubChem CID105383255
Molecular FormulaC16H18FNO2
Molecular Weight275.32 g/mol
Exact Mass275.13
IUPAC Name[3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol
SMILESCc1ccc(C(C)C)c(Oc2nccc(CO)c2F)c1
InChIInChI=1S/C16H18FNO2/c1-10(2)13-5-4-11(3)8-14(13)20-16-15(17)12(9-19)6-7-18-16/h4-8,10,19H,9H2,1-3H3
InChIKeySXNYUUKDJULUJJ-UHFFFAOYSA-N
XLogP3.94
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.32
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(chloromethyl)-3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)pyridine
CID 105383793
[3-fluoro-2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanol
CID 105383273
3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)pyridine-4-carboxylic acid
CID 105379913
[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol
CID 105383279
[2-(2-butan-2-ylphenoxy)-3-fluoro-4-pyridinyl]methanol
CID 105383274
[4-chloro-2-(5-methyl-2-propan-2-ylphenoxy)phenyl]methanol
CID 114846021
[2-(2-chlorophenoxy)-3-fluoro-4-pyridinyl]methanol
CID 105383259
[2-(2-chloro-4-methylphenoxy)-3-fluoro-4-pyridinyl]methanamine
CID 105391433
[4,6-dimethyl-2-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 61256294
[3-fluoro-2-[2-(trifluoromethyl)phenoxy]-4-pyridinyl]methanol
CID 105383241
[2-(2-bromo-4-methylphenoxy)-3-fluoro-4-pyridinyl]methanamine
CID 105391301
2-(chloromethyl)-4-(5-methyl-2-propan-2-ylphenoxy)pyridine
CID 61269909

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol?
The IUPAC name of [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol (CID 105383255) is [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol.
What is the SMILES notation for [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol?
The canonical SMILES for [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol is Cc1ccc(C(C)C)c(Oc2nccc(CO)c2F)c1.
What is the InChIKey of [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol?
The InChIKey is SXNYUUKDJULUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO2/c1-10(2)13-5-4-11(3)8-14(13)20-16-15(17)12(9-19)6-7-18-16/h4-8,10,19H,9H2,1-3H3.
What are the key properties of [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol?
[3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol has a molecular weight of 275.32 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)-4-pyridinyl]methanol is sourced from PubChem (CID 105383255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).