6-naphthalen-2-yl-3-propan-2-yldibenzofuran

C25H20O — CID 164821911

IUPAC6-naphthalen-2-yl-3-propan-2-yldibenzofuran
SMILESCC(C)c1ccc2c(c1)oc1c(-c3ccc4ccccc4c3)cccc12
InChIInChI=1S/C25H20O/c1-16(2)18-12-13-22-23-9-5-8-21(25(23)26-24(22)15-18)20-11-10-17-6-3-4-7-19(17)14-20/h3-16H,1-2H3
InChIKeyRAOOLYLJFDCFLK-UHFFFAOYSA-N
MW336.43 g/mol
LogP7.53
Rot. Bonds2

About 6-naphthalen-2-yl-3-propan-2-yldibenzofuran

6-naphthalen-2-yl-3-propan-2-yldibenzofuran (PubChem CID 164821911) has the molecular formula C25H20O and a molecular weight of 336.43 g/mol. Its IUPAC name is 6-naphthalen-2-yl-3-propan-2-yldibenzofuran.

Molecular Properties

Compound Name6-naphthalen-2-yl-3-propan-2-yldibenzofuran
PubChem CID164821911
Molecular FormulaC25H20O
Molecular Weight336.43 g/mol
Exact Mass336.15
IUPAC Name6-naphthalen-2-yl-3-propan-2-yldibenzofuran
SMILESCC(C)c1ccc2c(c1)oc1c(-c3ccc4ccccc4c3)cccc12
InChIInChI=1S/C25H20O/c1-16(2)18-12-13-22-23-9-5-8-21(25(23)26-24(22)15-18)20-11-10-17-6-3-4-7-19(17)14-20/h3-16H,1-2H3
InChIKeyRAOOLYLJFDCFLK-UHFFFAOYSA-N
XLogP7.53
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.43
LogP ≤ 57.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]dibenzofuran
CID 67963999
2-(4-naphthalen-2-ylphenyl)-4-[4-(6-phenyldibenzofuran-3-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 170213977
2-[4-(4-propan-2-ylphenyl)naphthalen-1-yl]dibenzofuran;3-[4-(4-propan-2-ylphenyl)naphthalen-1-yl]dibenzofuran;4-[4-(4-propan-2-ylphenyl)naphthalen-1-yl]dibenzofuran;4-[4-[4-[4-(4-propan-2-ylphenyl)phenyl]phenyl]phenyl]dibenzofuran
CID 157495963
2-[3,5-di(dibenzofuran-4-yl)phenyl]-4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-6-naphthalen-2-yl-1,3,5-triazine
CID 153466225
4-[6-(6-phenylpyren-1-yl)naphthalen-2-yl]dibenzofuran
CID 58273738
2-(3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaen-5-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 149219825
2-(8-naphthalen-2-ylpyren-1-yl)-6-phenyldibenzofuran
CID 170150575
2-naphthalen-2-yl-4-(7-naphthalen-2-yldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 176765189
6-naphthalen-2-yl-3-[6-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]naphthalen-2-yl]dibenzofuran
CID 167407103
4-(9-phenanthren-2-ylchrysen-3-yl)dibenzofuran
CID 118520836
6-phenyl-3-[6-(6-phenyldibenzofuran-3-yl)pyren-1-yl]dibenzofuran
CID 176846437
4-[4-(2,10-dinaphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran
CID 58323570

Frequently Asked Questions

What is the IUPAC name of 6-naphthalen-2-yl-3-propan-2-yldibenzofuran?
The IUPAC name of 6-naphthalen-2-yl-3-propan-2-yldibenzofuran (CID 164821911) is 6-naphthalen-2-yl-3-propan-2-yldibenzofuran.
What is the SMILES notation for 6-naphthalen-2-yl-3-propan-2-yldibenzofuran?
The canonical SMILES for 6-naphthalen-2-yl-3-propan-2-yldibenzofuran is CC(C)c1ccc2c(c1)oc1c(-c3ccc4ccccc4c3)cccc12.
What is the InChIKey of 6-naphthalen-2-yl-3-propan-2-yldibenzofuran?
The InChIKey is RAOOLYLJFDCFLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20O/c1-16(2)18-12-13-22-23-9-5-8-21(25(23)26-24(22)15-18)20-11-10-17-6-3-4-7-19(17)14-20/h3-16H,1-2H3.
What are the key properties of 6-naphthalen-2-yl-3-propan-2-yldibenzofuran?
6-naphthalen-2-yl-3-propan-2-yldibenzofuran has a molecular weight of 336.43 g/mol, XLogP of 7.53, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-naphthalen-2-yl-3-propan-2-yldibenzofuran is sourced from PubChem (CID 164821911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).