1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol

C16H18O2 — CID 113362057

IUPAC1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol
SMILESOC(CC1CCOC1)c1ccc2ccccc2c1
InChIInChI=1S/C16H18O2/c17-16(9-12-7-8-18-11-12)15-6-5-13-3-1-2-4-14(13)10-15/h1-6,10,12,16-17H,7-9,11H2
InChIKeyJOFFQQXUUXPVBD-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.30
Rot. Bonds3

About 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol

1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol (PubChem CID 113362057) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol
PubChem CID113362057
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol
SMILESOC(CC1CCOC1)c1ccc2ccccc2c1
InChIInChI=1S/C16H18O2/c17-16(9-12-7-8-18-11-12)15-6-5-13-3-1-2-4-14(13)10-15/h1-6,10,12,16-17H,7-9,11H2
InChIKeyJOFFQQXUUXPVBD-UHFFFAOYSA-N
XLogP3.30
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine
CID 103987345
1-(4-fluorophenyl)-2-(oxolan-3-yl)ethanol
CID 103986410
1-(4-cyclopropyloxyphenyl)-2-(oxolan-3-yl)ethanol
CID 114519142
1-(oxolan-3-yl)-3-quinolin-2-ylpropan-2-ol
CID 103986478
1-(2-fluorophenyl)-2-(oxolan-3-yl)ethanol
CID 103986373
3-cyclohexyl-1-naphthalen-2-ylpropan-1-ol
CID 115792765
2-(5-methylmorpholin-3-yl)-1-naphthalen-2-ylethanol
CID 116685528
N-(2-hydroxy-2-naphthalen-2-ylethyl)oxane-4-carboxamide
CID 111112227
1-(2,6-difluorophenyl)-2-(oxolan-3-yl)ethanol
CID 103986582
1-[3-(difluoromethyl)phenyl]-2-(oxan-4-yl)ethanol
CID 115527745
1-(5-fluoro-3-pyridinyl)-2-(oxolan-3-yl)ethanol
CID 103986451
1-(3-chloro-4-methylphenyl)-2-(oxan-4-yl)ethanol
CID 115789651

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol?
The IUPAC name of 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol (CID 113362057) is 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol.
What is the SMILES notation for 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol?
The canonical SMILES for 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol is OC(CC1CCOC1)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol?
The InChIKey is JOFFQQXUUXPVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c17-16(9-12-7-8-18-11-12)15-6-5-13-3-1-2-4-14(13)10-15/h1-6,10,12,16-17H,7-9,11H2.
What are the key properties of 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol?
1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol has a molecular weight of 242.32 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol is sourced from PubChem (CID 113362057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).