2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane

C18H22O2 — CID 90144658

IUPAC2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane
SMILESCC(C)c1ccc2ccc(OCC3CCCO3)cc2c1
InChIInChI=1S/C18H22O2/c1-13(2)15-6-5-14-7-8-17(11-16(14)10-15)20-12-18-4-3-9-19-18/h5-8,10-11,13,18H,3-4,9,12H2,1-2H3
InChIKeyZEZUASWEQXPVER-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.52
Rot. Bonds4

About 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane

2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane (PubChem CID 90144658) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane.

Molecular Properties

Compound Name2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane
PubChem CID90144658
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane
SMILESCC(C)c1ccc2ccc(OCC3CCCO3)cc2c1
InChIInChI=1S/C18H22O2/c1-13(2)15-6-5-14-7-8-17(11-16(14)10-15)20-12-18-4-3-9-19-18/h5-8,10-11,13,18H,3-4,9,12H2,1-2H3
InChIKeyZEZUASWEQXPVER-UHFFFAOYSA-N
XLogP4.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-[4-(oxolan-2-ylmethoxy)phenyl]ethanol
CID 63364123
4-(oxolan-2-ylmethoxy)-N-[2-(4-propan-2-ylphenoxy)ethyl]aniline
CID 54799699
3-(oxolan-2-ylmethoxy)-N-[2-(4-propan-2-ylphenoxy)propyl]aniline
CID 46736356
4-methoxy-3-[7-(oxolan-2-ylmethoxy)naphthalen-2-yl]pyridine
CID 172671316
6-(oxetan-2-ylmethoxy)naphthalen-2-ol
CID 22482657
2-[(4-iodophenoxy)methyl]oxolane
CID 60644314
2-[3-chloro-3-(6-methoxynaphthalen-2-yl)propyl]oxolane
CID 65157833
2-ethoxy-6-[[(2S)-oxolan-2-yl]methoxy]quinazoline
CID 91462378
N-methyl-4-(oxolan-2-ylmethoxy)aniline
CID 54803460
2-[(3-tert-butylphenoxy)methyl]oxolane
CID 59734486
2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide
CID 9295169
(1R)-1-[2-fluoro-4-(oxan-2-ylmethoxy)phenyl]ethanol
CID 107719943

Frequently Asked Questions

What is the IUPAC name of 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane?
The IUPAC name of 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane (CID 90144658) is 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane.
What is the SMILES notation for 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane?
The canonical SMILES for 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane is CC(C)c1ccc2ccc(OCC3CCCO3)cc2c1.
What is the InChIKey of 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane?
The InChIKey is ZEZUASWEQXPVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-13(2)15-6-5-14-7-8-17(11-16(14)10-15)20-12-18-4-3-9-19-18/h5-8,10-11,13,18H,3-4,9,12H2,1-2H3.
What are the key properties of 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane?
2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane has a molecular weight of 270.37 g/mol, XLogP of 4.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(7-propan-2-ylnaphthalen-2-yl)oxymethyl]oxolane is sourced from PubChem (CID 90144658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).