7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran

C23H16O — CID 166938715

IUPAC7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran
SMILESCc1ccccc1-c1cccc2oc3c4ccccc4ccc3c12
InChIInChI=1S/C23H16O/c1-15-7-2-4-9-17(15)19-11-6-12-21-22(19)20-14-13-16-8-3-5-10-18(16)23(20)24-21/h2-14H,1H3
InChIKeyZUFFWRLMMBDWMN-UHFFFAOYSA-N
MW308.38 g/mol
LogP6.71
Rot. Bonds1

About 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran

7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran (PubChem CID 166938715) has the molecular formula C23H16O and a molecular weight of 308.38 g/mol. Its IUPAC name is 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran.

Molecular Properties

Compound Name7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran
PubChem CID166938715
Molecular FormulaC23H16O
Molecular Weight308.38 g/mol
Exact Mass308.12
IUPAC Name7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran
SMILESCc1ccccc1-c1cccc2oc3c4ccccc4ccc3c12
InChIInChI=1S/C23H16O/c1-15-7-2-4-9-17(15)19-11-6-12-21-22(19)20-14-13-16-8-3-5-10-18(16)23(20)24-21/h2-14H,1H3
InChIKeyZUFFWRLMMBDWMN-UHFFFAOYSA-N
XLogP6.71
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.38
LogP ≤ 56.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran?
The IUPAC name of 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran (CID 166938715) is 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran.
What is the SMILES notation for 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran?
The canonical SMILES for 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran is Cc1ccccc1-c1cccc2oc3c4ccccc4ccc3c12.
What is the InChIKey of 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran?
The InChIKey is ZUFFWRLMMBDWMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16O/c1-15-7-2-4-9-17(15)19-11-6-12-21-22(19)20-14-13-16-8-3-5-10-18(16)23(20)24-21/h2-14H,1H3.
What are the key properties of 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran?
7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran has a molecular weight of 308.38 g/mol, XLogP of 6.71, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methylphenyl)naphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 166938715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).