3-naphthalen-1-yloxyoxane

C15H16O2 — CID 107137916

IUPAC3-naphthalen-1-yloxyoxane
SMILESc1ccc2c(OC3CCCOC3)cccc2c1
InChIInChI=1S/C15H16O2/c1-2-8-14-12(5-1)6-3-9-15(14)17-13-7-4-10-16-11-13/h1-3,5-6,8-9,13H,4,7,10-11H2
InChIKeySOJYEPDWFIVBKJ-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.40
Rot. Bonds2

About 3-naphthalen-1-yloxyoxane

3-naphthalen-1-yloxyoxane (PubChem CID 107137916) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-naphthalen-1-yloxyoxane.

Molecular Properties

Compound Name3-naphthalen-1-yloxyoxane
PubChem CID107137916
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name3-naphthalen-1-yloxyoxane
SMILESc1ccc2c(OC3CCCOC3)cccc2c1
InChIInChI=1S/C15H16O2/c1-2-8-14-12(5-1)6-3-9-15(14)17-13-7-4-10-16-11-13/h1-3,5-6,8-9,13H,4,7,10-11H2
InChIKeySOJYEPDWFIVBKJ-UHFFFAOYSA-N
XLogP3.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[2-methoxy-3-(oxan-3-yloxy)phenyl]methanol
CID 84700687
N-methyl-1-[2-(oxan-3-yloxy)naphthalen-1-yl]methanamine
CID 107134305
3-[2-(chloromethyl)phenoxy]oxane
CID 107135119
2-methyl-3-(oxan-3-yloxy)phenol
CID 107135241
2-amino-3-(oxan-3-yloxy)phenol
CID 107134115
3-[2-methoxy-3-(oxan-3-yloxy)phenyl]propan-1-amine
CID 117417565
3-[2-(oxan-3-yloxy)phenyl]propanal
CID 117340444
1-[[2-(oxan-3-yloxy)phenyl]methyl]cyclopropan-1-ol
CID 117374038
2-methoxy-3-(oxan-3-yloxy)benzoic acid
CID 115005205
(1S)-1-[2-(oxan-3-yloxy)phenyl]propan-1-ol
CID 107135067
(E)-3-[2-(oxan-3-yloxy)phenyl]prop-2-en-1-amine
CID 117338381
4-[2-methoxy-3-(oxan-3-yloxy)phenyl]butanoic acid
CID 117474860

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-1-yloxyoxane?
The IUPAC name of 3-naphthalen-1-yloxyoxane (CID 107137916) is 3-naphthalen-1-yloxyoxane.
What is the SMILES notation for 3-naphthalen-1-yloxyoxane?
The canonical SMILES for 3-naphthalen-1-yloxyoxane is c1ccc2c(OC3CCCOC3)cccc2c1.
What is the InChIKey of 3-naphthalen-1-yloxyoxane?
The InChIKey is SOJYEPDWFIVBKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-2-8-14-12(5-1)6-3-9-15(14)17-13-7-4-10-16-11-13/h1-3,5-6,8-9,13H,4,7,10-11H2.
What are the key properties of 3-naphthalen-1-yloxyoxane?
3-naphthalen-1-yloxyoxane has a molecular weight of 228.29 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-1-yloxyoxane is sourced from PubChem (CID 107137916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).