2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol

C13H14O3 — CID 117310764

IUPAC2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol
SMILESCOc1cccc2c(O)c(CCO)ccc12
InChIInChI=1S/C13H14O3/c1-16-12-4-2-3-11-10(12)6-5-9(7-8-14)13(11)15/h2-6,14-15H,7-8H2,1H3
InChIKeyKYDMWBOSYRKQKL-UHFFFAOYSA-N
MW218.25 g/mol
LogP2.09
Rot. Bonds3

About 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol

2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol (PubChem CID 117310764) has the molecular formula C13H14O3 and a molecular weight of 218.25 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol
PubChem CID117310764
Molecular FormulaC13H14O3
Molecular Weight218.25 g/mol
Exact Mass218.09
IUPAC Name2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol
SMILESCOc1cccc2c(O)c(CCO)ccc12
InChIInChI=1S/C13H14O3/c1-16-12-4-2-3-11-10(12)6-5-9(7-8-14)13(11)15/h2-6,14-15H,7-8H2,1H3
InChIKeyKYDMWBOSYRKQKL-UHFFFAOYSA-N
XLogP2.09
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1,5-dimethoxynaphthalen-2-yl)methanol
CID 117310761
2-(7-methoxy-1-benzofuran-3-yl)ethanol
CID 22662935
2-(2-hydroxyethyl)-6-(hydroxymethyl)phenol
CID 117276602
ethane;2-methoxy-6-propylphenol
CID 142869062
2-[2-amino-3-(2,6-dimethoxyphenyl)phenyl]ethanol
CID 154291295
(5-methoxynaphthalen-1-yl)methanamine
CID 59401298
2-[(2-methoxyphenyl)methyl]naphthalen-1-ol
CID 15617840
2-(2-ethyl-6-methoxyphenyl)ethanol
CID 143738643
methanol;1-methoxynaphthalene;neptunium
CID 157299455
2,4-dimethoxynaphthalen-1-ol
CID 12563547
2-bromo-6-(2-hydroxyethyl)phenol
CID 57283538
2-[4-(2-hydroxyethyl)naphthalen-1-yl]ethanol
CID 12582392

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol?
The IUPAC name of 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol (CID 117310764) is 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol.
What is the SMILES notation for 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol?
The canonical SMILES for 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol is COc1cccc2c(O)c(CCO)ccc12.
What is the InChIKey of 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol?
The InChIKey is KYDMWBOSYRKQKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O3/c1-16-12-4-2-3-11-10(12)6-5-9(7-8-14)13(11)15/h2-6,14-15H,7-8H2,1H3.
What are the key properties of 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol?
2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol has a molecular weight of 218.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-5-methoxynaphthalen-1-ol is sourced from PubChem (CID 117310764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).