2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene

C22H18O3 — CID 168858344

IUPAC2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene
SMILESCOc1ccc2ccccc2c1Oc1c(OC)ccc2ccccc12
InChIInChI=1S/C22H18O3/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)25-22-18-10-6-4-8-16(18)12-14-20(22)24-2/h3-14H,1-2H3
InChIKeyKORWKWBGHYMUFN-UHFFFAOYSA-N
MW330.38 g/mol
LogP5.80
Rot. Bonds4

About 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene

2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene (PubChem CID 168858344) has the molecular formula C22H18O3 and a molecular weight of 330.38 g/mol. Its IUPAC name is 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene.

Molecular Properties

Compound Name2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene
PubChem CID168858344
Molecular FormulaC22H18O3
Molecular Weight330.38 g/mol
Exact Mass330.13
IUPAC Name2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene
SMILESCOc1ccc2ccccc2c1Oc1c(OC)ccc2ccccc12
InChIInChI=1S/C22H18O3/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)25-22-18-10-6-4-8-16(18)12-14-20(22)24-2/h3-14H,1-2H3
InChIKeyKORWKWBGHYMUFN-UHFFFAOYSA-N
XLogP5.80
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.38
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene?
The IUPAC name of 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene (CID 168858344) is 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene.
What is the SMILES notation for 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene?
The canonical SMILES for 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene is COc1ccc2ccccc2c1Oc1c(OC)ccc2ccccc12.
What is the InChIKey of 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene?
The InChIKey is KORWKWBGHYMUFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18O3/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)25-22-18-10-6-4-8-16(18)12-14-20(22)24-2/h3-14H,1-2H3.
What are the key properties of 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene?
2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene has a molecular weight of 330.38 g/mol, XLogP of 5.80, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene is sourced from PubChem (CID 168858344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).