4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran

C31H24O — CID 121440850

IUPAC4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran
SMILESCCC(c1ccc(-c2cccc3c2oc2ccccc23)cc1)c1cccc2ccccc12
InChIInChI=1S/C31H24O/c1-2-24(27-14-7-10-21-9-3-4-11-25(21)27)22-17-19-23(20-18-22)26-13-8-15-29-28-12-5-6-16-30(28)32-31(26)29/h3-20,24H,2H2,1H3
InChIKeyIEJZVRPMCXVZOV-UHFFFAOYSA-N
MW412.53 g/mol
LogP8.95
Rot. Bonds4

About 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran

4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran (PubChem CID 121440850) has the molecular formula C31H24O and a molecular weight of 412.53 g/mol. Its IUPAC name is 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran.

Molecular Properties

Compound Name4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran
PubChem CID121440850
Molecular FormulaC31H24O
Molecular Weight412.53 g/mol
Exact Mass412.18
IUPAC Name4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran
SMILESCCC(c1ccc(-c2cccc3c2oc2ccccc23)cc1)c1cccc2ccccc12
InChIInChI=1S/C31H24O/c1-2-24(27-14-7-10-21-9-3-4-11-25(21)27)22-17-19-23(20-18-22)26-13-8-15-29-28-12-5-6-16-30(28)32-31(26)29/h3-20,24H,2H2,1H3
InChIKeyIEJZVRPMCXVZOV-UHFFFAOYSA-N
XLogP8.95
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.53
LogP ≤ 58.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran 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-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]phenyl]dibenzofuran
CID 59136882
4-[4-[1-(4-phenylphenyl)ethyl]phenyl]dibenzofuran
CID 174178014
4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran
CID 67963999
4-[3-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]phenyl]dibenzofuran
CID 59136983
N-(4-dibenzofuran-4-ylphenyl)-4-naphthalen-1-yl-N-phenylaniline
CID 162494606
4-[4-[phenanthren-9-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 59136825
N-(4-dibenzofuran-4-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)aniline
CID 159404463
4-[4-[1-(4-naphthalen-1-ylphenyl)-2-(9,9'-spirobi[fluorene]-1'-yl)ethyl]phenyl]dibenzofuran
CID 166825044
4-[4-[4-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]phenyl]dibenzofuran
CID 59136660
4-[4-[bis[4-(3-phenylphenyl)phenyl]methyl]phenyl]dibenzofuran
CID 59137016
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59136875
4-(4-propylphenyl)dibenzofuran
CID 156827246

Frequently Asked Questions

What is the IUPAC name of 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran?
The IUPAC name of 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran (CID 121440850) is 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran.
What is the SMILES notation for 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran?
The canonical SMILES for 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran is CCC(c1ccc(-c2cccc3c2oc2ccccc23)cc1)c1cccc2ccccc12.
What is the InChIKey of 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran?
The InChIKey is IEJZVRPMCXVZOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24O/c1-2-24(27-14-7-10-21-9-3-4-11-25(21)27)22-17-19-23(20-18-22)26-13-8-15-29-28-12-5-6-16-30(28)32-31(26)29/h3-20,24H,2H2,1H3.
What are the key properties of 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran?
4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran has a molecular weight of 412.53 g/mol, XLogP of 8.95, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1-naphthalen-1-ylpropyl)phenyl]dibenzofuran is sourced from PubChem (CID 121440850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).