9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine

C67H56N2 — CID 58389946

IUPAC9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
SMILESCCCCC1(CCCC)c2cc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3)c3ccc(-c4cccc5ccccc45)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C67H56N2/c1-3-5-43-67(44-6-4-2)63-45-53(39-41-59(63)60-42-40-54(46-64(60)67)69-65-29-16-14-26-61(65)62-27-15-17-30-66(62)69)68(52-37-33-50(34-38-52)58-28-18-22-48-21-10-11-23-56(48)58)51-35-31-49(32-36-51)57-25-13-12-24-55(57)47-19-8-7-9-20-47/h7-42,45-46H,3-6,43-44H2,1-2H3
InChIKeyRZMYPZBSUHHBNS-UHFFFAOYSA-N
MW889.20 g/mol
LogP19.05
Rot. Bonds13

About 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine

9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine (PubChem CID 58389946) has the molecular formula C67H56N2 and a molecular weight of 889.20 g/mol. Its IUPAC name is 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine.

Molecular Properties

Compound Name9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
PubChem CID58389946
Molecular FormulaC67H56N2
Molecular Weight889.20 g/mol
Exact Mass888.44
IUPAC Name9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
SMILESCCCCC1(CCCC)c2cc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3)c3ccc(-c4cccc5ccccc45)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C67H56N2/c1-3-5-43-67(44-6-4-2)63-45-53(39-41-59(63)60-42-40-54(46-64(60)67)69-65-29-16-14-26-61(65)62-27-15-17-30-66(62)69)68(52-37-33-50(34-38-52)58-28-18-22-48-21-10-11-23-56(48)58)51-35-31-49(32-36-51)57-25-13-12-24-55(57)47-19-8-7-9-20-47/h7-42,45-46H,3-6,43-44H2,1-2H3
InChIKeyRZMYPZBSUHHBNS-UHFFFAOYSA-N
XLogP19.05
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500889.20
LogP ≤ 519.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9,9-dibutyl-7-carbazol-9-yl-N-[3-(2-phenylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 90085878
7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 58389884
7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)fluoren-2-amine
CID 58390128
7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline
CID 157400056
N-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-naphthalen-1-yl-N-phenylfluoren-2-amine
CID 58390108
9,9-diethyl-N-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 147008099
7-carbazol-9-yl-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]fluoren-2-amine
CID 89212902
7-carbazol-9-yl-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine
CID 71038406
7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390079
9,9-dimethyl-N-(3-naphthalen-1-yl-4-phenylphenyl)-N-phenyl-7-(3-phenylcarbazol-9-yl)fluoren-2-amine
CID 90085898
6-benzo[b]carbazol-5-yl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 167038052
N-(4-carbazol-9-ylphenyl)-3-naphthalen-1-yl-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]aniline
CID 172501687

Frequently Asked Questions

What is the IUPAC name of 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine?
The IUPAC name of 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine (CID 58389946) is 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine.
What is the SMILES notation for 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine?
The canonical SMILES for 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine is CCCCC1(CCCC)c2cc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3)c3ccc(-c4cccc5ccccc45)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.
What is the InChIKey of 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine?
The InChIKey is RZMYPZBSUHHBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H56N2/c1-3-5-43-67(44-6-4-2)63-45-53(39-41-59(63)60-42-40-54(46-64(60)67)69-65-29-16-14-26-61(65)62-27-15-17-30-66(62)69)68(52-37-33-50(34-38-52)58-28-18-22-48-21-10-11-23-56(48)58)51-35-31-49(32-36-51)57-25-13-12-24-55(57)47-19-8-7-9-20-47/h7-42,45-46H,3-6,43-44H2,1-2H3.
What are the key properties of 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine?
9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine has a molecular weight of 889.20 g/mol, XLogP of 19.05, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dibutyl-7-carbazol-9-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine is sourced from PubChem (CID 58389946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).