4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane

C18H20O2 — CID 176513410

IUPAC4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane
SMILESC=Cc1c(OCC2CCOCC2)ccc2ccccc12
InChIInChI=1S/C18H20O2/c1-2-16-17-6-4-3-5-15(17)7-8-18(16)20-13-14-9-11-19-12-10-14/h2-8,14H,1,9-13H2
InChIKeyFTRWPTKKVOVBBM-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.29
Rot. Bonds4

About 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane

4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane (PubChem CID 176513410) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane.

Molecular Properties

Compound Name4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane
PubChem CID176513410
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane
SMILESC=Cc1c(OCC2CCOCC2)ccc2ccccc12
InChIInChI=1S/C18H20O2/c1-2-16-17-6-4-3-5-15(17)7-8-18(16)20-13-14-9-11-19-12-10-14/h2-8,14H,1,9-13H2
InChIKeyFTRWPTKKVOVBBM-UHFFFAOYSA-N
XLogP4.29
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[1-(chloromethyl)naphthalen-2-yl]oxymethyl]oxane
CID 62385709
[2-(oxan-4-ylmethoxy)naphthalen-1-yl]methanamine
CID 62386750
(1S)-1-[2-(oxan-4-ylmethoxy)phenyl]propan-1-amine
CID 78932889
1-ethenyl-2-(2-methoxyethoxy)naphthalene
CID 176513404
1-[2-(oxan-4-ylmethoxy)phenyl]propan-1-ol
CID 62386971
4-[[2-(bromomethyl)phenoxy]methyl]oxane
CID 62387338
1-(2-ethoxyphenyl)-2-(oxan-4-ylmethoxy)ethanol
CID 62383597
N-methyl-1-[4-(oxan-4-ylmethoxy)quinolin-2-yl]methanamine
CID 63377188
2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine
CID 54930636
4-(oxan-4-ylmethoxy)quinazolin-2-amine
CID 80880152
1-(2-ethoxynaphthalen-1-yl)oxy-3-(oxan-4-yloxy)propan-2-ol
CID 167904392
3-chloro-4-(oxan-4-ylmethoxy)benzaldehyde
CID 55066357

Frequently Asked Questions

What is the IUPAC name of 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane?
The IUPAC name of 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane (CID 176513410) is 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane.
What is the SMILES notation for 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane?
The canonical SMILES for 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane is C=Cc1c(OCC2CCOCC2)ccc2ccccc12.
What is the InChIKey of 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane?
The InChIKey is FTRWPTKKVOVBBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-2-16-17-6-4-3-5-15(17)7-8-18(16)20-13-14-9-11-19-12-10-14/h2-8,14H,1,9-13H2.
What are the key properties of 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane?
4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane has a molecular weight of 268.36 g/mol, XLogP of 4.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-ethenylnaphthalen-2-yl)oxymethyl]oxane is sourced from PubChem (CID 176513410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).