3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol

C16H18O4 — CID 143727870

IUPAC3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol
SMILESCOc1ccc(COc2cc(O)cc(CCO)c2)cc1
InChIInChI=1S/C16H18O4/c1-19-15-4-2-12(3-5-15)11-20-16-9-13(6-7-17)8-14(18)10-16/h2-5,8-10,17-18H,6-7,11H2,1H3
InChIKeyQIUJNANSPZTGSV-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.51
Rot. Bonds6

About 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol

3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol (PubChem CID 143727870) has the molecular formula C16H18O4 and a molecular weight of 274.32 g/mol. Its IUPAC name is 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol.

Molecular Properties

Compound Name3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol
PubChem CID143727870
Molecular FormulaC16H18O4
Molecular Weight274.32 g/mol
Exact Mass274.12
IUPAC Name3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol
SMILESCOc1ccc(COc2cc(O)cc(CCO)c2)cc1
InChIInChI=1S/C16H18O4/c1-19-15-4-2-12(3-5-15)11-20-16-9-13(6-7-17)8-14(18)10-16/h2-5,8-10,17-18H,6-7,11H2,1H3
InChIKeyQIUJNANSPZTGSV-UHFFFAOYSA-N
XLogP2.51
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol?
The IUPAC name of 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol (CID 143727870) is 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol.
What is the SMILES notation for 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol?
The canonical SMILES for 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol is COc1ccc(COc2cc(O)cc(CCO)c2)cc1.
What is the InChIKey of 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol?
The InChIKey is QIUJNANSPZTGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O4/c1-19-15-4-2-12(3-5-15)11-20-16-9-13(6-7-17)8-14(18)10-16/h2-5,8-10,17-18H,6-7,11H2,1H3.
What are the key properties of 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol?
3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol has a molecular weight of 274.32 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethyl)-5-[(4-methoxyphenyl)methoxy]phenol is sourced from PubChem (CID 143727870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).