10-methylnaphtho[1,2-b][1]benzofuran

C17H12O — CID 58510874

IUPAC10-methylnaphtho[1,2-b][1]benzofuran
SMILESCc1cccc2c1oc1c3ccccc3ccc21
InChIInChI=1S/C17H12O/c1-11-5-4-8-14-15-10-9-12-6-2-3-7-13(12)17(15)18-16(11)14/h2-10H,1H3
InChIKeyWLFKRZITUYLICD-UHFFFAOYSA-N
MW232.28 g/mol
LogP5.05
Rot. Bonds

About 10-methylnaphtho[1,2-b][1]benzofuran

10-methylnaphtho[1,2-b][1]benzofuran (PubChem CID 58510874) has the molecular formula C17H12O and a molecular weight of 232.28 g/mol. Its IUPAC name is 10-methylnaphtho[1,2-b][1]benzofuran.

Molecular Properties

Compound Name10-methylnaphtho[1,2-b][1]benzofuran
PubChem CID58510874
Molecular FormulaC17H12O
Molecular Weight232.28 g/mol
Exact Mass232.09
IUPAC Name10-methylnaphtho[1,2-b][1]benzofuran
SMILESCc1cccc2c1oc1c3ccccc3ccc21
InChIInChI=1S/C17H12O/c1-11-5-4-8-14-15-10-9-12-6-2-3-7-13(12)17(15)18-16(11)14/h2-10H,1H3
InChIKeyWLFKRZITUYLICD-UHFFFAOYSA-N
XLogP5.05
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500232.28
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10-methylnaphtho[1,2-b][1]benzofuran?
The IUPAC name of 10-methylnaphtho[1,2-b][1]benzofuran (CID 58510874) is 10-methylnaphtho[1,2-b][1]benzofuran.
What is the SMILES notation for 10-methylnaphtho[1,2-b][1]benzofuran?
The canonical SMILES for 10-methylnaphtho[1,2-b][1]benzofuran is Cc1cccc2c1oc1c3ccccc3ccc21.
What is the InChIKey of 10-methylnaphtho[1,2-b][1]benzofuran?
The InChIKey is WLFKRZITUYLICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12O/c1-11-5-4-8-14-15-10-9-12-6-2-3-7-13(12)17(15)18-16(11)14/h2-10H,1H3.
What are the key properties of 10-methylnaphtho[1,2-b][1]benzofuran?
10-methylnaphtho[1,2-b][1]benzofuran has a molecular weight of 232.28 g/mol, XLogP of 5.05, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methylnaphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 58510874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).