7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine

C53H42N2 — CID 134370640

IUPAC7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
SMILESCc1cc(C)cc(-c2cccc(-c3cccc(N(c4ccccc4)c4ccc5c(c4)C(C)(C)c4cc(-n6c7ccccc7c7ccccc76)ccc4-5)c3)c2)c1
InChIInChI=1S/C53H42N2/c1-35-28-36(2)30-40(29-35)38-15-12-14-37(31-38)39-16-13-19-42(32-39)54(41-17-6-5-7-18-41)43-24-26-45-46-27-25-44(34-50(46)53(3,4)49(45)33-43)55-51-22-10-8-20-47(51)48-21-9-11-23-52(48)55/h5-34H,1-4H3
InChIKeyCDUQULVCBIRRRS-UHFFFAOYSA-N
MW706.93 g/mol
LogP14.51
Rot. Bonds6

About 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine

7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine (PubChem CID 134370640) has the molecular formula C53H42N2 and a molecular weight of 706.93 g/mol. Its IUPAC name is 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine.

Molecular Properties

Compound Name7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
PubChem CID134370640
Molecular FormulaC53H42N2
Molecular Weight706.93 g/mol
Exact Mass706.33
IUPAC Name7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
SMILESCc1cc(C)cc(-c2cccc(-c3cccc(N(c4ccccc4)c4ccc5c(c4)C(C)(C)c4cc(-n6c7ccccc7c7ccccc76)ccc4-5)c3)c2)c1
InChIInChI=1S/C53H42N2/c1-35-28-36(2)30-40(29-35)38-15-12-14-37(31-38)39-16-13-19-42(32-39)54(41-17-6-5-7-18-41)43-24-26-45-46-27-25-44(34-50(46)53(3,4)49(45)33-43)55-51-22-10-8-20-47(51)48-21-9-11-23-52(48)55/h5-34H,1-4H3
InChIKeyCDUQULVCBIRRRS-UHFFFAOYSA-N
XLogP14.51
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500706.93
LogP ≤ 514.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-carbazol-9-yl-N-[4-(3,5-dimethylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 134370655
9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine
CID 135163375
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390067
9,9-dimethyl-N-phenyl-7-(3-phenylcarbazol-9-yl)-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 58390142
9,9-dimethyl-N-phenyl-7-(3-phenylcarbazol-9-yl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390145
7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-2-ylphenyl)-N-phenylfluoren-2-amine
CID 58390006
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[3-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 58389919
7-carbazol-9-yl-N-[4-[3-[4-[3-(2,6-dimethylphenyl)carbazol-9-yl]phenyl]-5-phenylphenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 134370793
N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine;N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158799608
N-[3-[3-[4-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 90185797
1-N,3-N-bis(9,9-dimethylfluoren-2-yl)-5-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-1-N,3-N-diphenylbenzene-1,3-diamine
CID 87174605
7-carbazol-9-yl-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 58389898

Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
The IUPAC name of 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine (CID 134370640) is 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine.
What is the SMILES notation for 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
The canonical SMILES for 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine is Cc1cc(C)cc(-c2cccc(-c3cccc(N(c4ccccc4)c4ccc5c(c4)C(C)(C)c4cc(-n6c7ccccc7c7ccccc76)ccc4-5)c3)c2)c1.
What is the InChIKey of 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
The InChIKey is CDUQULVCBIRRRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H42N2/c1-35-28-36(2)30-40(29-35)38-15-12-14-37(31-38)39-16-13-19-42(32-39)54(41-17-6-5-7-18-41)43-24-26-45-46-27-25-44(34-50(46)53(3,4)49(45)33-43)55-51-22-10-8-20-47(51)48-21-9-11-23-52(48)55/h5-34H,1-4H3.
What are the key properties of 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine has a molecular weight of 706.93 g/mol, XLogP of 14.51, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine is sourced from PubChem (CID 134370640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).