9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole

C52H53N — CID 89431658

IUPAC9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole
SMILESCCCC(C)(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(C)(C)c1cc(C(C)(CCC)n3c4ccccc4c4ccccc43)ccc1-2
InChIInChI=1S/C52H53N/c1-9-29-51(7,34-23-26-38-37-17-11-14-20-43(37)49(3,4)44(38)31-34)35-24-27-39-40-28-25-36(33-46(40)50(5,6)45(39)32-35)52(8,30-10-2)53-47-21-15-12-18-41(47)42-19-13-16-22-48(42)53/h11-28,31-33H,9-10,29-30H2,1-8H3
InChIKeyJRHANCZSBCOWMR-UHFFFAOYSA-N
MW692.00 g/mol
LogP14.08
Rot. Bonds8

About 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole

9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole (PubChem CID 89431658) has the molecular formula C52H53N and a molecular weight of 692.00 g/mol. Its IUPAC name is 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole.

Molecular Properties

Compound Name9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole
PubChem CID89431658
Molecular FormulaC52H53N
Molecular Weight692.00 g/mol
Exact Mass691.42
IUPAC Name9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole
SMILESCCCC(C)(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(C)(C)c1cc(C(C)(CCC)n3c4ccccc4c4ccccc43)ccc1-2
InChIInChI=1S/C52H53N/c1-9-29-51(7,34-23-26-38-37-17-11-14-20-43(37)49(3,4)44(38)31-34)35-24-27-39-40-28-25-36(33-46(40)50(5,6)45(39)32-35)52(8,30-10-2)53-47-21-15-12-18-41(47)42-19-13-16-22-48(42)53/h11-28,31-33H,9-10,29-30H2,1-8H3
InChIKeyJRHANCZSBCOWMR-UHFFFAOYSA-N
XLogP14.08
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500692.00
LogP ≤ 514.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole 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

9-tert-butyl-2-[3-(9,9-dimethylfluoren-3-yl)-2,2-dimethylpropyl]carbazole
CID 154939340
3-[9,10-bis(4-tert-butylphenyl)-6-(9-phenylcarbazol-3-yl)anthracen-2-yl]-9-phenylcarbazole;3-[9,10-bis(9,9-dimethylfluoren-2-yl)-6-(9-phenylcarbazol-3-yl)anthracen-2-yl]-9-phenylcarbazole
CID 159087841
N-(4-tert-butylphenyl)-9-(9,9-dimethylfluoren-2-yl)-N-triphenylen-2-ylcarbazol-2-amine
CID 126738644
9-[7-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]-9,9-dimethylfluoren-2-yl]carbazole
CID 58676147
5-[4-[9-(4-tert-butylphenyl)carbazol-2-yl]phenyl]-11,11-dimethylindeno[1,2-b]carbazole
CID 118042341
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene
CID 143017257
3-[3,10-bis(9,9-dimethylfluoren-2-yl)anthracen-9-yl]-9-methylcarbazole
CID 59195703
11,11-dimethyl-5-phenanthren-9-ylindeno[1,2-b]carbazole
CID 118488779
9-(9,9-dimethylfluoren-2-yl)carbazole;toluene
CID 145272995
2-carbazol-9-yl-9-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]carbazole
CID 121274445
10-phenyl-N-[2-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)butan-2-yl]anthracen-9-amine
CID 90368522

Frequently Asked Questions

What is the IUPAC name of 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole?
The IUPAC name of 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole (CID 89431658) is 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole.
What is the SMILES notation for 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole?
The canonical SMILES for 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole is CCCC(C)(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(C)(C)c1cc(C(C)(CCC)n3c4ccccc4c4ccccc43)ccc1-2.
What is the InChIKey of 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole?
The InChIKey is JRHANCZSBCOWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H53N/c1-9-29-51(7,34-23-26-38-37-17-11-14-20-43(37)49(3,4)44(38)31-34)35-24-27-39-40-28-25-36(33-46(40)50(5,6)45(39)32-35)52(8,30-10-2)53-47-21-15-12-18-41(47)42-19-13-16-22-48(42)53/h11-28,31-33H,9-10,29-30H2,1-8H3.
What are the key properties of 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole?
9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole has a molecular weight of 692.00 g/mol, XLogP of 14.08, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-[7-[2-(9,9-dimethylfluoren-2-yl)pentan-2-yl]-9,9-dimethylfluoren-2-yl]pentan-2-yl]carbazole is sourced from PubChem (CID 89431658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).