7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine

C61H44N2 — CID 58390079

IUPAC7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine
SMILESCC1(C)c2cc(N(c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c3cccc(-c4cccc5ccccc45)c3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C61H44N2/c1-61(2)57-39-49(33-35-53(57)54-36-34-50(40-58(54)61)63-59-27-10-8-24-55(59)56-25-9-11-28-60(56)63)62(48-22-13-20-46(38-48)52-26-14-18-44-17-6-7-23-51(44)52)47-21-12-19-45(37-47)43-31-29-42(30-32-43)41-15-4-3-5-16-41/h3-40H,1-2H3
InChIKeyPEOJNUWIVVPBRW-UHFFFAOYSA-N
MW805.04 g/mol
LogP16.71
Rot. Bonds7

About 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine

7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine (PubChem CID 58390079) has the molecular formula C61H44N2 and a molecular weight of 805.04 g/mol. Its IUPAC name is 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine.

Molecular Properties

Compound Name7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine
PubChem CID58390079
Molecular FormulaC61H44N2
Molecular Weight805.04 g/mol
Exact Mass804.35
IUPAC Name7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine
SMILESCC1(C)c2cc(N(c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c3cccc(-c4cccc5ccccc45)c3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C61H44N2/c1-61(2)57-39-49(33-35-53(57)54-36-34-50(40-58(54)61)63-59-27-10-8-24-55(59)56-25-9-11-28-60(56)63)62(48-22-13-20-46(38-48)52-26-14-18-44-17-6-7-23-51(44)52)47-21-12-19-45(37-47)43-31-29-42(30-32-43)41-15-4-3-5-16-41/h3-40H,1-2H3
InChIKeyPEOJNUWIVVPBRW-UHFFFAOYSA-N
XLogP16.71
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500805.04
LogP ≤ 516.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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
N-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-naphthalen-1-yl-N-phenylfluoren-2-amine
CID 58390108
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390067
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
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-(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-(3-naphthalen-2-ylphenyl)-N-phenylfluoren-2-amine
CID 58390006
9,9-dimethyl-N-phenyl-7-(3-phenylcarbazol-9-yl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390145
9,9-dimethyl-N-(3-naphthalen-1-yl-4-phenylphenyl)-N-phenyl-7-(3-phenylcarbazol-9-yl)fluoren-2-amine
CID 90085898
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine
CID 90393592
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[3-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 58389919

Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine?
The IUPAC name of 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine (CID 58390079) is 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine.
What is the SMILES notation for 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine?
The canonical SMILES for 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine is CC1(C)c2cc(N(c3cccc(-c4ccc(-c5ccccc5)cc4)c3)c3cccc(-c4cccc5ccccc45)c3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.
What is the InChIKey of 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine?
The InChIKey is PEOJNUWIVVPBRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H44N2/c1-61(2)57-39-49(33-35-53(57)54-36-34-50(40-58(54)61)63-59-27-10-8-24-55(59)56-25-9-11-28-60(56)63)62(48-22-13-20-46(38-48)52-26-14-18-44-17-6-7-23-51(44)52)47-21-12-19-45(37-47)43-31-29-42(30-32-43)41-15-4-3-5-16-41/h3-40H,1-2H3.
What are the key properties of 7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine?
7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine has a molecular weight of 805.04 g/mol, XLogP of 16.71, 7 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-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine is sourced from PubChem (CID 58390079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).