(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol

C16H17FO2 — CID 62301823

IUPAC(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol
SMILESCCOc1ccc(C)cc1C(O)c1cccc(F)c1
InChIInChI=1S/C16H17FO2/c1-3-19-15-8-7-11(2)9-14(15)16(18)12-5-4-6-13(17)10-12/h4-10,16,18H,3H2,1-2H3
InChIKeyYYGIUXMMXZZVRH-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.61
Rot. Bonds4

About (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol

(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol (PubChem CID 62301823) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol.

Molecular Properties

Compound Name(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol
PubChem CID62301823
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol
SMILESCCOc1ccc(C)cc1C(O)c1cccc(F)c1
InChIInChI=1S/C16H17FO2/c1-3-19-15-8-7-11(2)9-14(15)16(18)12-5-4-6-13(17)10-12/h4-10,16,18H,3H2,1-2H3
InChIKeyYYGIUXMMXZZVRH-UHFFFAOYSA-N
XLogP3.61
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-4-fluorophenyl)-(2-ethoxy-5-methylphenyl)methanol
CID 62303344
(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol
CID 105489348
(2-fluoro-4-methylphenyl)-(3-fluorophenyl)methanol
CID 114978479
(3-chloro-2-fluorophenyl)-(2-ethoxy-5-methylphenyl)methanol
CID 81266896
(3-bromo-4-methoxyphenyl)-(2-ethoxy-5-methylphenyl)methanol
CID 62302503
(2-ethoxy-5-methylphenyl)-(2-methylphenyl)methanol
CID 62302666
(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol
CID 61082247
(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115827523
(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
CID 63364902
(3-fluorophenyl)-(2,4,5-trimethoxyphenyl)methanol
CID 63895832
(2-ethoxyphenyl)-(2-fluoro-5-methylphenyl)methanol
CID 63893443
(2,5-dimethoxyphenyl)-(3-fluorophenyl)methanol
CID 61099370

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol?
The IUPAC name of (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol (CID 62301823) is (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol.
What is the SMILES notation for (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol?
The canonical SMILES for (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol is CCOc1ccc(C)cc1C(O)c1cccc(F)c1.
What is the InChIKey of (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol?
The InChIKey is YYGIUXMMXZZVRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-3-19-15-8-7-11(2)9-14(15)16(18)12-5-4-6-13(17)10-12/h4-10,16,18H,3H2,1-2H3.
What are the key properties of (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol?
(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol has a molecular weight of 260.31 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol is sourced from PubChem (CID 62301823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).