(4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane

C13H18O3 — CID 155795428

IUPAC(4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane
SMILESCOc1ccccc1COC1C[C@@H](C)CO1
InChIInChI=1S/C13H18O3/c1-10-7-13(15-8-10)16-9-11-5-3-4-6-12(11)14-2/h3-6,10,13H,7-9H2,1-2H3/t10-,13?/m1/s1
InChIKeyKCKIHJFKHOLSAZ-VUUHIHSGSA-N
MW222.28 g/mol
LogP2.59
Rot. Bonds4

About (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane

(4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane (PubChem CID 155795428) has the molecular formula C13H18O3 and a molecular weight of 222.28 g/mol. Its IUPAC name is (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane.

Molecular Properties

Compound Name(4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane
PubChem CID155795428
Molecular FormulaC13H18O3
Molecular Weight222.28 g/mol
Exact Mass222.13
IUPAC Name(4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane
SMILESCOc1ccccc1COC1C[C@@H](C)CO1
InChIInChI=1S/C13H18O3/c1-10-7-13(15-8-10)16-9-11-5-3-4-6-12(11)14-2/h3-6,10,13H,7-9H2,1-2H3/t10-,13?/m1/s1
InChIKeyKCKIHJFKHOLSAZ-VUUHIHSGSA-N
XLogP2.59
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-oxazinane;hydrochloride
CID 117226870
triethyl-[(2-methoxyphenyl)methoxy]silane
CID 101046757
2-[(2,3-dimethoxyphenyl)methoxy]oxane
CID 11265241
[4-[(2-methoxyphenyl)methoxy]piperidin-1-yl]-[(2R,3S)-2-methyloxan-3-yl]methanone
CID 129400330
[4-[(2-methoxyphenyl)methoxy]piperidin-1-yl]-[(2S,3S)-2-methyloxan-3-yl]methanone
CID 129400331
2-[[2,6-bis[[2-(oxiran-2-yloxymethyl)phenyl]methyl]phenyl]methoxy]oxirane
CID 118910071
(1S,2R,4S)-2-[(2-methoxyphenyl)methoxy]-1,3-dimethyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
CID 170702964
2-N-[(2-methoxyphenyl)methyl]-2-N,3,5-trimethylcyclohexane-1,2-diamine
CID 64752913
(2-methoxyphenyl)methyl cyclopentanecarboxylate
CID 78760103
N-[(2-methoxyphenyl)methoxy]methanamine
CID 105433405
1-[(2-methoxyphenyl)methyl]-4-methylpiperidin-1-ium
CID 7321439
1-cyclobutyl-2-(2-methoxyphenyl)ethanone
CID 61079535

Frequently Asked Questions

What is the IUPAC name of (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane?
The IUPAC name of (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane (CID 155795428) is (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane.
What is the SMILES notation for (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane?
The canonical SMILES for (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane is COc1ccccc1COC1C[C@@H](C)CO1.
What is the InChIKey of (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane?
The InChIKey is KCKIHJFKHOLSAZ-VUUHIHSGSA-N. The full InChI is InChI=1S/C13H18O3/c1-10-7-13(15-8-10)16-9-11-5-3-4-6-12(11)14-2/h3-6,10,13H,7-9H2,1-2H3/t10-,13?/m1/s1.
What are the key properties of (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane?
(4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane has a molecular weight of 222.28 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-[(2-methoxyphenyl)methoxy]-4-methyloxolane is sourced from PubChem (CID 155795428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).