methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole

C38H29N — CID 158348177

IUPACmethane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
SMILESC.c1ccc(C2(c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C37H25N.CH4/c1-2-13-26(14-3-1)37(33-21-8-4-17-29(33)30-18-5-9-22-34(30)37)27-15-12-16-28(25-27)38-35-23-10-6-19-31(35)32-20-7-11-24-36(32)38;/h1-25H;1H4
InChIKeyGRZJYPQQVFXFCU-UHFFFAOYSA-N
MW499.66 g/mol
LogP9.78
Rot. Bonds3

About methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole

methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole (PubChem CID 158348177) has the molecular formula C38H29N and a molecular weight of 499.66 g/mol. Its IUPAC name is methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole.

Molecular Properties

Compound Namemethane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
PubChem CID158348177
Molecular FormulaC38H29N
Molecular Weight499.66 g/mol
Exact Mass499.23
IUPAC Namemethane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
SMILESC.c1ccc(C2(c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C37H25N.CH4/c1-2-13-26(14-3-1)37(33-21-8-4-17-29(33)30-18-5-9-22-34(30)37)27-15-12-16-28(25-27)38-35-23-10-6-19-31(35)32-20-7-11-24-36(32)38;/h1-25H;1H4
InChIKeyGRZJYPQQVFXFCU-UHFFFAOYSA-N
XLogP9.78
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms39
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500499.66
LogP ≤ 59.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole?
The IUPAC name of methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole (CID 158348177) is methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole.
What is the SMILES notation for methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole?
The canonical SMILES for methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole is C.c1ccc(C2(c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole?
The InChIKey is GRZJYPQQVFXFCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25N.CH4/c1-2-13-26(14-3-1)37(33-21-8-4-17-29(33)30-18-5-9-22-34(30)37)27-15-12-16-28(25-27)38-35-23-10-6-19-31(35)32-20-7-11-24-36(32)38;/h1-25H;1H4.
What are the key properties of methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole?
methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole has a molecular weight of 499.66 g/mol, XLogP of 9.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole is sourced from PubChem (CID 158348177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).