(1S)-1-(2-ethoxynaphthalen-1-yl)ethanol

C14H16O2 — CID 95420561

IUPAC(1S)-1-(2-ethoxynaphthalen-1-yl)ethanol
SMILESCCOc1ccc2ccccc2c1[C@H](C)O
InChIInChI=1S/C14H16O2/c1-3-16-13-9-8-11-6-4-5-7-12(11)14(13)10(2)15/h4-10,15H,3H2,1-2H3/t10-/m0/s1
InChIKeyUOYHKCJSMXTUGH-JTQLQIEISA-N
MW216.28 g/mol
LogP3.29
Rot. Bonds3

About (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol

(1S)-1-(2-ethoxynaphthalen-1-yl)ethanol (PubChem CID 95420561) has the molecular formula C14H16O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol.

Molecular Properties

Compound Name(1S)-1-(2-ethoxynaphthalen-1-yl)ethanol
PubChem CID95420561
Molecular FormulaC14H16O2
Molecular Weight216.28 g/mol
Exact Mass216.12
IUPAC Name(1S)-1-(2-ethoxynaphthalen-1-yl)ethanol
SMILESCCOc1ccc2ccccc2c1[C@H](C)O
InChIInChI=1S/C14H16O2/c1-3-16-13-9-8-11-6-4-5-7-12(11)14(13)10(2)15/h4-10,15H,3H2,1-2H3/t10-/m0/s1
InChIKeyUOYHKCJSMXTUGH-JTQLQIEISA-N
XLogP3.29
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethoxynaphthalen-1-yl)-1-hydroxypropan-2-one
CID 142273790
1-(2-ethoxynaphthalen-1-yl)-3-sulfanylpropane-1,2-diol
CID 170821052
3-amino-1-(2-ethoxynaphthalen-1-yl)propane-1,2-diol
CID 170829187
1-(2-ethoxynaphthalen-1-yl)propan-1-amine
CID 82263032
(1S)-1-(2-ethoxynaphthalen-1-yl)propan-1-amine
CID 95420558
(1R)-1-(2-ethoxynaphthalen-1-yl)-3-methylbutan-1-amine
CID 171213389
(1R)-1-(2-ethoxynaphthalen-1-yl)propan-1-amine;hydrochloride
CID 171213379
(3R)-3-amino-3-(2-ethoxynaphthalen-1-yl)propan-1-ol;hydrochloride
CID 171213425
methyl (2S)-2-amino-2-(2-ethoxynaphthalen-1-yl)acetate
CID 171213419
(1R)-1-(2-ethoxynaphthalen-1-yl)-2,2,2-trifluoroethanamine
CID 66512241
(1R)-1-(2-ethoxynaphthalen-1-yl)propane-1,3-diamine;hydrochloride
CID 171213373
(1S)-1-(2-ethoxynaphthalen-1-yl)-2,2,2-trifluoroethanamine
CID 66512251

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol?
The IUPAC name of (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol (CID 95420561) is (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol.
What is the SMILES notation for (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol?
The canonical SMILES for (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol is CCOc1ccc2ccccc2c1[C@H](C)O.
What is the InChIKey of (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol?
The InChIKey is UOYHKCJSMXTUGH-JTQLQIEISA-N. The full InChI is InChI=1S/C14H16O2/c1-3-16-13-9-8-11-6-4-5-7-12(11)14(13)10(2)15/h4-10,15H,3H2,1-2H3/t10-/m0/s1.
What are the key properties of (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol?
(1S)-1-(2-ethoxynaphthalen-1-yl)ethanol has a molecular weight of 216.28 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(2-ethoxynaphthalen-1-yl)ethanol is sourced from PubChem (CID 95420561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).