2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol

C18H20O4 — CID 69204599

IUPAC2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol
SMILESCOc1cccc(Cc2ccc(OC3CCOC3)cc2)c1O
InChIInChI=1S/C18H20O4/c1-20-17-4-2-3-14(18(17)19)11-13-5-7-15(8-6-13)22-16-9-10-21-12-16/h2-8,16,19H,9-12H2,1H3
InChIKeyDCPNXPRYWMKKMW-UHFFFAOYSA-N
MW300.35 g/mol
LogP3.16
Rot. Bonds5

About 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol

2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol (PubChem CID 69204599) has the molecular formula C18H20O4 and a molecular weight of 300.35 g/mol. Its IUPAC name is 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol.

Molecular Properties

Compound Name2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol
PubChem CID69204599
Molecular FormulaC18H20O4
Molecular Weight300.35 g/mol
Exact Mass300.14
IUPAC Name2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol
SMILESCOc1cccc(Cc2ccc(OC3CCOC3)cc2)c1O
InChIInChI=1S/C18H20O4/c1-20-17-4-2-3-14(18(17)19)11-13-5-7-15(8-6-13)22-16-9-10-21-12-16/h2-8,16,19H,9-12H2,1H3
InChIKeyDCPNXPRYWMKKMW-UHFFFAOYSA-N
XLogP3.16
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.35
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-3-[4-[(2-chlorophenyl)methyl]phenoxy]oxolane
CID 141288000
[3-methoxy-2-(oxolan-3-yloxy)phenyl]methanol
CID 63558981
(2S,3S,4R,5R,6S)-2-[2,4-dimethoxy-5-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(fluoromethyl)oxane-3,4,5-triol
CID 145042105
[2-methoxy-3-(oxolan-3-yloxy)phenyl]methanol
CID 84689080
(3S)-3-[4-[(2-chloro-5-ethylphenyl)methyl]phenoxy]oxolane
CID 118457980
(3S)-3-[4-[(3-iodophenyl)methyl]phenoxy]oxolane
CID 163202731
(3S)-3-(2-methoxyphenoxy)oxolane
CID 141103497
3-[4-[(2-chloro-5-ethylphenyl)methyl]phenoxy]oxolane;ethane
CID 176995671
[(2S,4R,6R)-6-[2,4-dimethoxy-5-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-4-fluorooxan-2-yl]methanol
CID 118973690
(3S)-3-[4-[(5-tert-butyl-2-chlorophenyl)methyl]phenoxy]oxolane
CID 90128332
N-[[4-(oxolan-3-yloxy)phenyl]methyl]ethanamine
CID 63557924
[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[2-[[4-[(3R)-oxolan-3-yl]oxyphenyl]methyl]phenoxy]oxan-2-yl]methyl acetate
CID 59711564

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol?
The IUPAC name of 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol (CID 69204599) is 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol.
What is the SMILES notation for 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol?
The canonical SMILES for 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol is COc1cccc(Cc2ccc(OC3CCOC3)cc2)c1O.
What is the InChIKey of 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol?
The InChIKey is DCPNXPRYWMKKMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O4/c1-20-17-4-2-3-14(18(17)19)11-13-5-7-15(8-6-13)22-16-9-10-21-12-16/h2-8,16,19H,9-12H2,1H3.
What are the key properties of 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol?
2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol has a molecular weight of 300.35 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[[4-(oxolan-3-yloxy)phenyl]methyl]phenol is sourced from PubChem (CID 69204599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).