4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile

C29H17NO — CID 70847339

IUPAC4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile
SMILESN#Cc1ccc(-c2ccc3ccc(-c4cccc5oc6ccccc6c45)cc3c2)cc1
InChIInChI=1S/C29H17NO/c30-18-19-8-10-20(11-9-19)22-14-12-21-13-15-23(17-24(21)16-22)25-5-3-7-28-29(25)26-4-1-2-6-27(26)31-28/h1-17H
InChIKeySDDZGURNBLKWHL-UHFFFAOYSA-N
MW395.46 g/mol
LogP7.94
Rot. Bonds2

About 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile

4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile (PubChem CID 70847339) has the molecular formula C29H17NO and a molecular weight of 395.46 g/mol. Its IUPAC name is 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile.

Molecular Properties

Compound Name4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile
PubChem CID70847339
Molecular FormulaC29H17NO
Molecular Weight395.46 g/mol
Exact Mass395.13
IUPAC Name4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile
SMILESN#Cc1ccc(-c2ccc3ccc(-c4cccc5oc6ccccc6c45)cc3c2)cc1
InChIInChI=1S/C29H17NO/c30-18-19-8-10-20(11-9-19)22-14-12-21-13-15-23(17-24(21)16-22)25-5-3-7-28-29(25)26-4-1-2-6-27(26)31-28/h1-17H
InChIKeySDDZGURNBLKWHL-UHFFFAOYSA-N
XLogP7.94
TPSA36.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.46
LogP ≤ 57.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-[4-(3-dibenzofuran-1-yl-5,6-diphenylpyrazin-2-yl)phenyl]phenyl]benzonitrile
CID 156509423
4-[4-[4-[9-(3-phenylphenyl)dibenzofuran-3-yl]-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 168774590
3-[4-[4-(9-naphthalen-2-yldibenzofuran-3-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 168774620
1-[6-(10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-yl]dibenzofuran
CID 146651916
4-[4-[4-(9-phenyldibenzofuran-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 168774820
4-(N-[4-[7-[4-(N-dibenzofuran-3-ylanilino)phenyl]naphthalen-2-yl]phenyl]-4-phenylanilino)benzonitrile
CID 149392924
4-(3-dibenzofuran-4-ylphenyl)benzonitrile
CID 90393148
2-dibenzofuran-1-yl-4-(7-dibenzofuran-1-ylnaphthalen-2-yl)-6-naphthalen-2-yl-1,3,5-triazine
CID 167008364
4-naphtho[2,1-b][1]benzofuran-10-ylbenzonitrile
CID 70847283
4-[9-(4-cyanophenyl)dibenzofuran-3-yl]-2-phenyl-6-(4-phenylphenyl)benzonitrile
CID 176994591
4-[7-(4-cyanophenyl)dibenzofuran-1-yl]-2,6-diphenylbenzonitrile
CID 176994433
3-[4-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]benzonitrile
CID 177112707

Frequently Asked Questions

What is the IUPAC name of 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile?
The IUPAC name of 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile (CID 70847339) is 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile.
What is the SMILES notation for 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile?
The canonical SMILES for 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile is N#Cc1ccc(-c2ccc3ccc(-c4cccc5oc6ccccc6c45)cc3c2)cc1.
What is the InChIKey of 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile?
The InChIKey is SDDZGURNBLKWHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H17NO/c30-18-19-8-10-20(11-9-19)22-14-12-21-13-15-23(17-24(21)16-22)25-5-3-7-28-29(25)26-4-1-2-6-27(26)31-28/h1-17H.
What are the key properties of 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile?
4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile has a molecular weight of 395.46 g/mol, XLogP of 7.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-dibenzofuran-1-ylnaphthalen-2-yl)benzonitrile is sourced from PubChem (CID 70847339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).