5H-[1]benzofuro[3,2-d][3]benzazepine

C16H11NO — CID 155818956

IUPAC5H-[1]benzofuro[3,2-d][3]benzazepine
SMILESC1=Nc2c(oc3ccccc23)-c2ccccc2C1
InChIInChI=1S/C16H11NO/c1-2-6-12-11(5-1)9-10-17-15-13-7-3-4-8-14(13)18-16(12)15/h1-8,10H,9H2
InChIKeyQFEDZGUYQCFMAZ-UHFFFAOYSA-N
MW233.27 g/mol
LogP4.36
Rot. Bonds

About 5H-[1]benzofuro[3,2-d][3]benzazepine

5H-[1]benzofuro[3,2-d][3]benzazepine (PubChem CID 155818956) has the molecular formula C16H11NO and a molecular weight of 233.27 g/mol. Its IUPAC name is 5H-[1]benzofuro[3,2-d][3]benzazepine.

Molecular Properties

Compound Name5H-[1]benzofuro[3,2-d][3]benzazepine
PubChem CID155818956
Molecular FormulaC16H11NO
Molecular Weight233.27 g/mol
Exact Mass233.08
IUPAC Name5H-[1]benzofuro[3,2-d][3]benzazepine
SMILESC1=Nc2c(oc3ccccc23)-c2ccccc2C1
InChIInChI=1S/C16H11NO/c1-2-6-12-11(5-1)9-10-17-15-13-7-3-4-8-14(13)18-16(12)15/h1-8,10H,9H2
InChIKeyQFEDZGUYQCFMAZ-UHFFFAOYSA-N
XLogP4.36
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1-(2-phenyl-1-benzofuran-3-yl)-3-(2-phenylphenyl)-2-benzofuran
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Frequently Asked Questions

What is the IUPAC name of 5H-[1]benzofuro[3,2-d][3]benzazepine?
The IUPAC name of 5H-[1]benzofuro[3,2-d][3]benzazepine (CID 155818956) is 5H-[1]benzofuro[3,2-d][3]benzazepine.
What is the SMILES notation for 5H-[1]benzofuro[3,2-d][3]benzazepine?
The canonical SMILES for 5H-[1]benzofuro[3,2-d][3]benzazepine is C1=Nc2c(oc3ccccc23)-c2ccccc2C1.
What is the InChIKey of 5H-[1]benzofuro[3,2-d][3]benzazepine?
The InChIKey is QFEDZGUYQCFMAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NO/c1-2-6-12-11(5-1)9-10-17-15-13-7-3-4-8-14(13)18-16(12)15/h1-8,10H,9H2.
What are the key properties of 5H-[1]benzofuro[3,2-d][3]benzazepine?
5H-[1]benzofuro[3,2-d][3]benzazepine has a molecular weight of 233.27 g/mol, XLogP of 4.36, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-[1]benzofuro[3,2-d][3]benzazepine is sourced from PubChem (CID 155818956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).