7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine

C67H50N2 — CID 144690386

IUPAC7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESC=Cc1ccc(CC2(Cc3ccc(C=C)cc3)c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)ccc3-c3ccc(-n4c5ccccc5c5ccccc54)cc32)cc1
InChIInChI=1S/C67H50N2/c1-3-47-23-27-49(28-24-47)45-67(46-50-29-25-48(4-2)26-30-50)63-43-57(39-41-59(63)60-42-40-58(44-64(60)67)69-65-21-13-11-19-61(65)62-20-12-14-22-66(62)69)68(55-35-31-53(32-36-55)51-15-7-5-8-16-51)56-37-33-54(34-38-56)52-17-9-6-10-18-52/h3-44H,1-2,45-46H2
InChIKeySLPZZRLRDSKAFF-UHFFFAOYSA-N
MW883.15 g/mol
LogP17.63
Rot. Bonds12

About 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine

7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine (PubChem CID 144690386) has the molecular formula C67H50N2 and a molecular weight of 883.15 g/mol. Its IUPAC name is 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine
PubChem CID144690386
Molecular FormulaC67H50N2
Molecular Weight883.15 g/mol
Exact Mass882.40
IUPAC Name7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESC=Cc1ccc(CC2(Cc3ccc(C=C)cc3)c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)ccc3-c3ccc(-n4c5ccccc5c5ccccc54)cc32)cc1
InChIInChI=1S/C67H50N2/c1-3-47-23-27-49(28-24-47)45-67(46-50-29-25-48(4-2)26-30-50)63-43-57(39-41-59(63)60-42-40-58(44-64(60)67)69-65-21-13-11-19-61(65)62-20-12-14-22-66(62)69)68(55-35-31-53(32-36-55)51-15-7-5-8-16-51)56-37-33-54(34-38-56)52-17-9-6-10-18-52/h3-44H,1-2,45-46H2
InChIKeySLPZZRLRDSKAFF-UHFFFAOYSA-N
XLogP17.63
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms69
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500883.15
LogP ≤ 517.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine (CID 144690386) is 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine is C=Cc1ccc(CC2(Cc3ccc(C=C)cc3)c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)ccc3-c3ccc(-n4c5ccccc5c5ccccc54)cc32)cc1.
What is the InChIKey of 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The InChIKey is SLPZZRLRDSKAFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H50N2/c1-3-47-23-27-49(28-24-47)45-67(46-50-29-25-48(4-2)26-30-50)63-43-57(39-41-59(63)60-42-40-58(44-64(60)67)69-65-21-13-11-19-61(65)62-20-12-14-22-66(62)69)68(55-35-31-53(32-36-55)51-15-7-5-8-16-51)56-37-33-54(34-38-56)52-17-9-6-10-18-52/h3-44H,1-2,45-46H2.
What are the key properties of 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine?
7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine has a molecular weight of 883.15 g/mol, XLogP of 17.63, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-carbazol-9-yl-9,9-bis[(4-ethenylphenyl)methyl]-N,N-bis(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 144690386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).