9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene

C48H34 — CID 15494424

IUPAC9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene
SMILESc1ccc2c(c1)-c1ccccc1C2CCC1c2cc(-c3cccc4ccccc34)ccc2-c2ccc(-c3cccc4ccccc34)cc21
InChIInChI=1S/C48H34/c1-3-15-35-31(11-1)13-9-21-37(35)33-23-25-44-45-26-24-34(38-22-10-14-32-12-2-4-16-36(32)38)30-48(45)46(47(44)29-33)28-27-43-41-19-7-5-17-39(41)40-18-6-8-20-42(40)43/h1-26,29-30,43,46H,27-28H2
InChIKeyZDTLYVCJFADPAV-UHFFFAOYSA-N
MW610.80 g/mol
LogP13.03
Rot. Bonds5

About 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene

9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene (PubChem CID 15494424) has the molecular formula C48H34 and a molecular weight of 610.80 g/mol. Its IUPAC name is 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene.

Molecular Properties

Compound Name9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene
PubChem CID15494424
Molecular FormulaC48H34
Molecular Weight610.80 g/mol
Exact Mass610.27
IUPAC Name9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene
SMILESc1ccc2c(c1)-c1ccccc1C2CCC1c2cc(-c3cccc4ccccc34)ccc2-c2ccc(-c3cccc4ccccc34)cc21
InChIInChI=1S/C48H34/c1-3-15-35-31(11-1)13-9-21-37(35)33-23-25-44-45-26-24-34(38-22-10-14-32-12-2-4-16-36(32)38)30-48(45)46(47(44)29-33)28-27-43-41-19-7-5-17-39(41)40-18-6-8-20-42(40)43/h1-26,29-30,43,46H,27-28H2
InChIKeyZDTLYVCJFADPAV-UHFFFAOYSA-N
XLogP13.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500610.80
LogP ≤ 513.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene 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

11-[2-(9H-fluoren-9-yl)ethyl]-11H-benzo[b]fluorene
CID 15494429
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
9-[4-[3-[4-(9H-fluoren-9-yl)phenyl]-5-naphthalen-1-ylphenyl]phenyl]-9H-fluorene
CID 58556083
2-naphthalen-1-ylanthracene
CID 2748705
2,7-dinaphthalen-1-ylfluoren-9-one
CID 146504296
1-(2-methyl-4-naphthalen-1-ylphenyl)naphthalene
CID 145377660
9-naphthalen-1-yl-10-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]anthracene
CID 153466528
2-methyl-9-[2-(2-methyl-9H-fluoren-9-yl)ethyl]-9H-fluorene
CID 15494405
1-[4-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]naphthalene
CID 10983707
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
1-(3-naphthalen-2-ylphenyl)naphthalene
CID 153293143

Frequently Asked Questions

What is the IUPAC name of 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene?
The IUPAC name of 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene (CID 15494424) is 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene.
What is the SMILES notation for 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene?
The canonical SMILES for 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene is c1ccc2c(c1)-c1ccccc1C2CCC1c2cc(-c3cccc4ccccc34)ccc2-c2ccc(-c3cccc4ccccc34)cc21.
What is the InChIKey of 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene?
The InChIKey is ZDTLYVCJFADPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34/c1-3-15-35-31(11-1)13-9-21-37(35)33-23-25-44-45-26-24-34(38-22-10-14-32-12-2-4-16-36(32)38)30-48(45)46(47(44)29-33)28-27-43-41-19-7-5-17-39(41)40-18-6-8-20-42(40)43/h1-26,29-30,43,46H,27-28H2.
What are the key properties of 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene?
9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene has a molecular weight of 610.80 g/mol, XLogP of 13.03, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene is sourced from PubChem (CID 15494424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).