4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran

C31H24O3 — CID 122215151

IUPAC4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran
SMILESCOc1ccc2ccccc2c1-c1c2c(c3c(c1-c1cccc4ccccc14)COC3)COC2
InChIInChI=1S/C31H24O3/c1-32-28-14-13-20-8-3-5-11-22(20)30(28)31-27-18-34-16-25(27)24-15-33-17-26(24)29(31)23-12-6-9-19-7-2-4-10-21(19)23/h2-14H,15-18H2,1H3
InChIKeyKWBCSPOYOXZHPJ-UHFFFAOYSA-N
MW444.53 g/mol
LogP7.40
Rot. Bonds3

About 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran

4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran (PubChem CID 122215151) has the molecular formula C31H24O3 and a molecular weight of 444.53 g/mol. Its IUPAC name is 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran.

Molecular Properties

Compound Name4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran
PubChem CID122215151
Molecular FormulaC31H24O3
Molecular Weight444.53 g/mol
Exact Mass444.17
IUPAC Name4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran
SMILESCOc1ccc2ccccc2c1-c1c2c(c3c(c1-c1cccc4ccccc14)COC3)COC2
InChIInChI=1S/C31H24O3/c1-32-28-14-13-20-8-3-5-11-22(20)30(28)31-27-18-34-16-25(27)24-15-33-17-26(24)29(31)23-12-6-9-19-7-2-4-10-21(19)23/h2-14H,15-18H2,1H3
InChIKeyKWBCSPOYOXZHPJ-UHFFFAOYSA-N
XLogP7.40
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.53
LogP ≤ 57.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran with MolForge

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Related Compounds

1-(2,4,6-trimethoxyphenyl)naphthalene
CID 71363627
[1-(2-methoxynaphthalen-1-yl)naphthalen-2-yl]oxyphosphane
CID 129073654
2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene
CID 11017918
[6-(2-methoxynaphthalen-1-yl)-7-methyl-1,3-dihydro-2-benzofuran-5-yl]oxy-diphenylphosphane
CID 70911302
2-(4-methoxyphenyl)-1-naphthalen-1-ylnaphthalene
CID 10737250
barium(2+);bis(1-(2-methoxynaphthalen-1-yl)naphthalen-2-olate)
CID 10952722
1-[2-(chloromethyl)phenyl]-2-methoxynaphthalene
CID 169227684
6-diethoxyphosphoryl-5-(2-methoxynaphthalen-1-yl)-4-methyl-1,3-dihydro-2-benzofuran
CID 59216878
1-(2-methoxynaphthalen-1-yl)-3,4-dihydronaphthalen-2-ol
CID 162414492
7-(2-methoxynaphthalen-1-yl)benzo[a]anthracene
CID 71619168
methoxy-methyl-(1-naphthalen-1-ylnaphthalen-2-yl)oxyphosphane
CID 143270912
[6-methoxy-5-[2-methoxy-6-(naphthalene-1-carbonyl)naphthalen-1-yl]naphthalen-2-yl]-naphthalen-1-ylmethanone
CID 101460356

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran?
The IUPAC name of 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran (CID 122215151) is 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran.
What is the SMILES notation for 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran?
The canonical SMILES for 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran is COc1ccc2ccccc2c1-c1c2c(c3c(c1-c1cccc4ccccc14)COC3)COC2.
What is the InChIKey of 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran?
The InChIKey is KWBCSPOYOXZHPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24O3/c1-32-28-14-13-20-8-3-5-11-22(20)30(28)31-27-18-34-16-25(27)24-15-33-17-26(24)29(31)23-12-6-9-19-7-2-4-10-21(19)23/h2-14H,15-18H2,1H3.
What are the key properties of 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran?
4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran has a molecular weight of 444.53 g/mol, XLogP of 7.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxynaphthalen-1-yl)-5-naphthalen-1-yl-1,3,6,8-tetrahydrofuro[3,4-e][2]benzofuran is sourced from PubChem (CID 122215151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).