(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol

C18H22O3 — CID 78933863

IUPAC(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol
SMILESC[C@@H](O)c1ccc2ccccc2c1OCC1CCCCO1
InChIInChI=1S/C18H22O3/c1-13(19)16-10-9-14-6-2-3-8-17(14)18(16)21-12-15-7-4-5-11-20-15/h2-3,6,8-10,13,15,19H,4-5,7,11-12H2,1H3/t13-,15?/m1/s1
InChIKeyYTDLNMLGNQRDBS-AFYYWNPRSA-N
MW286.37 g/mol
LogP3.84
Rot. Bonds4

About (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol

(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol (PubChem CID 78933863) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol
PubChem CID78933863
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol
SMILESC[C@@H](O)c1ccc2ccccc2c1OCC1CCCCO1
InChIInChI=1S/C18H22O3/c1-13(19)16-10-9-14-6-2-3-8-17(14)18(16)21-12-15-7-4-5-11-20-15/h2-3,6,8-10,13,15,19H,4-5,7,11-12H2,1H3/t13-,15?/m1/s1
InChIKeyYTDLNMLGNQRDBS-AFYYWNPRSA-N
XLogP3.84
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine
CID 63368500
(1R)-1-[4-fluoro-2-(oxan-2-ylmethoxy)phenyl]ethanol
CID 63365868
(1S)-1-(1-cyclopentyloxynaphthalen-2-yl)ethanol
CID 78933591
(1R)-1-[2-fluoro-4-(oxan-2-ylmethoxy)phenyl]ethanol
CID 107719943
1-[1-[2-(oxolan-2-yl)ethoxy]naphthalen-2-yl]ethanamine
CID 65158928
(1R)-1-[4-methyl-2-(oxolan-2-ylmethoxy)phenyl]ethanol
CID 78947367
2-[2-(oxan-2-ylmethoxy)naphthalen-1-yl]ethanamine
CID 60905678
(1S)-1-[3-methoxy-4-(oxan-2-ylmethoxy)phenyl]ethanol
CID 63364699
(1S)-1-(1-hexoxynaphthalen-2-yl)ethanol
CID 78944606
3-[2-[(1R)-1-hydroxyethyl]naphthalen-1-yl]oxyoxolan-2-one
CID 63365343
(1S)-1-[4-(oxolan-2-ylmethoxy)phenyl]ethanol
CID 63364123
4-[2-(oxan-2-ylmethoxy)naphthalen-1-yl]benzamide
CID 172666445

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol?
The IUPAC name of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol (CID 78933863) is (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol.
What is the SMILES notation for (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol?
The canonical SMILES for (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol is C[C@@H](O)c1ccc2ccccc2c1OCC1CCCCO1.
What is the InChIKey of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol?
The InChIKey is YTDLNMLGNQRDBS-AFYYWNPRSA-N. The full InChI is InChI=1S/C18H22O3/c1-13(19)16-10-9-14-6-2-3-8-17(14)18(16)21-12-15-7-4-5-11-20-15/h2-3,6,8-10,13,15,19H,4-5,7,11-12H2,1H3/t13-,15?/m1/s1.
What are the key properties of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol?
(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol has a molecular weight of 286.37 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol is sourced from PubChem (CID 78933863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).