9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole

C38H25N — CID 170284108

IUPAC9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole
SMILESc1ccc2c(c1)Cc1cc(-c3cccc4c3-c3cc(-n5c6ccccc6c6ccccc65)ccc3C4)ccc1-2
InChIInChI=1S/C38H25N/c1-2-10-30-24(8-1)21-28-22-25(17-19-31(28)30)32-13-7-9-27-20-26-16-18-29(23-35(26)38(27)32)39-36-14-5-3-11-33(36)34-12-4-6-15-37(34)39/h1-19,22-23H,20-21H2
InChIKeyLGVFSQQFYMVTTI-UHFFFAOYSA-N
MW495.63 g/mol
LogP9.59
Rot. Bonds2

About 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole

9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole (PubChem CID 170284108) has the molecular formula C38H25N and a molecular weight of 495.63 g/mol. Its IUPAC name is 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole.

Molecular Properties

Compound Name9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole
PubChem CID170284108
Molecular FormulaC38H25N
Molecular Weight495.63 g/mol
Exact Mass495.20
IUPAC Name9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole
SMILESc1ccc2c(c1)Cc1cc(-c3cccc4c3-c3cc(-n5c6ccccc6c6ccccc65)ccc3C4)ccc1-2
InChIInChI=1S/C38H25N/c1-2-10-30-24(8-1)21-28-22-25(17-19-31(28)30)32-13-7-9-27-20-26-16-18-29(23-35(26)38(27)32)39-36-14-5-3-11-33(36)34-12-4-6-15-37(34)39/h1-19,22-23H,20-21H2
InChIKeyLGVFSQQFYMVTTI-UHFFFAOYSA-N
XLogP9.59
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms39
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500495.63
LogP ≤ 59.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole?
The IUPAC name of 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole (CID 170284108) is 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole.
What is the SMILES notation for 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole?
The canonical SMILES for 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole is c1ccc2c(c1)Cc1cc(-c3cccc4c3-c3cc(-n5c6ccccc6c6ccccc65)ccc3C4)ccc1-2.
What is the InChIKey of 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole?
The InChIKey is LGVFSQQFYMVTTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25N/c1-2-10-30-24(8-1)21-28-22-25(17-19-31(28)30)32-13-7-9-27-20-26-16-18-29(23-35(26)38(27)32)39-36-14-5-3-11-33(36)34-12-4-6-15-37(34)39/h1-19,22-23H,20-21H2.
What are the key properties of 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole?
9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole has a molecular weight of 495.63 g/mol, XLogP of 9.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[5-(9H-fluoren-2-yl)-9H-fluoren-3-yl]carbazole is sourced from PubChem (CID 170284108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).