2-(6-methoxynaphthalen-2-yl)-1-benzofuran

C19H14O2 — CID 11076624

IUPAC2-(6-methoxynaphthalen-2-yl)-1-benzofuran
SMILESCOc1ccc2cc(-c3cc4ccccc4o3)ccc2c1
InChIInChI=1S/C19H14O2/c1-20-17-9-8-13-10-16(7-6-14(13)11-17)19-12-15-4-2-3-5-18(15)21-19/h2-12H,1H3
InChIKeyPHFJAODRBDSBPX-UHFFFAOYSA-N
MW274.32 g/mol
LogP5.26
Rot. Bonds2

About 2-(6-methoxynaphthalen-2-yl)-1-benzofuran

2-(6-methoxynaphthalen-2-yl)-1-benzofuran (PubChem CID 11076624) has the molecular formula C19H14O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-(6-methoxynaphthalen-2-yl)-1-benzofuran.

Molecular Properties

Compound Name2-(6-methoxynaphthalen-2-yl)-1-benzofuran
PubChem CID11076624
Molecular FormulaC19H14O2
Molecular Weight274.32 g/mol
Exact Mass274.10
IUPAC Name2-(6-methoxynaphthalen-2-yl)-1-benzofuran
SMILESCOc1ccc2cc(-c3cc4ccccc4o3)ccc2c1
InChIInChI=1S/C19H14O2/c1-20-17-9-8-13-10-16(7-6-14(13)11-17)19-12-15-4-2-3-5-18(15)21-19/h2-12H,1H3
InChIKeyPHFJAODRBDSBPX-UHFFFAOYSA-N
XLogP5.26
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.32
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxynaphthalen-2-yl)-1-benzofuran?
The IUPAC name of 2-(6-methoxynaphthalen-2-yl)-1-benzofuran (CID 11076624) is 2-(6-methoxynaphthalen-2-yl)-1-benzofuran.
What is the SMILES notation for 2-(6-methoxynaphthalen-2-yl)-1-benzofuran?
The canonical SMILES for 2-(6-methoxynaphthalen-2-yl)-1-benzofuran is COc1ccc2cc(-c3cc4ccccc4o3)ccc2c1.
What is the InChIKey of 2-(6-methoxynaphthalen-2-yl)-1-benzofuran?
The InChIKey is PHFJAODRBDSBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O2/c1-20-17-9-8-13-10-16(7-6-14(13)11-17)19-12-15-4-2-3-5-18(15)21-19/h2-12H,1H3.
What are the key properties of 2-(6-methoxynaphthalen-2-yl)-1-benzofuran?
2-(6-methoxynaphthalen-2-yl)-1-benzofuran has a molecular weight of 274.32 g/mol, XLogP of 5.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxynaphthalen-2-yl)-1-benzofuran is sourced from PubChem (CID 11076624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).