N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine

C55H40N2 — CID 168809293

IUPACN-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
SMILESCC1(C)c2ccccc2-c2cccc(N(c3ccc(-c4ccccc4)cc3)c3ccccc3-c3c(-n4c5ccccc5c5ccccc54)ccc4ccccc34)c21
InChIInChI=1S/C55H40N2/c1-55(2)47-26-12-8-21-42(47)45-25-16-30-52(54(45)55)56(40-34-31-38(32-35-40)37-17-4-3-5-18-37)50-29-15-11-24-46(50)53-41-20-7-6-19-39(41)33-36-51(53)57-48-27-13-9-22-43(48)44-23-10-14-28-49(44)57/h3-36H,1-2H3
InChIKeyANZLVADHLUCGKM-UHFFFAOYSA-N
MW728.94 g/mol
LogP15.05
Rot. Bonds6

About N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine

N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine (PubChem CID 168809293) has the molecular formula C55H40N2 and a molecular weight of 728.94 g/mol. Its IUPAC name is N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine.

Molecular Properties

Compound NameN-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
PubChem CID168809293
Molecular FormulaC55H40N2
Molecular Weight728.94 g/mol
Exact Mass728.32
IUPAC NameN-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
SMILESCC1(C)c2ccccc2-c2cccc(N(c3ccc(-c4ccccc4)cc3)c3ccccc3-c3c(-n4c5ccccc5c5ccccc54)ccc4ccccc34)c21
InChIInChI=1S/C55H40N2/c1-55(2)47-26-12-8-21-42(47)45-25-16-30-52(54(45)55)56(40-34-31-38(32-35-40)37-17-4-3-5-18-37)50-29-15-11-24-46(50)53-41-20-7-6-19-39(41)33-36-51(53)57-48-27-13-9-22-43(48)44-23-10-14-28-49(44)57/h3-36H,1-2H3
InChIKeyANZLVADHLUCGKM-UHFFFAOYSA-N
XLogP15.05
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500728.94
LogP ≤ 515.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2-carbazol-9-ylphenyl)phenyl]-9,9-dimethyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-1-amine
CID 168789356
N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine
CID 168809021
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-1-amine
CID 170142818
N-(2-carbazol-9-ylphenyl)-2-(9,9-dimethylfluoren-4-yl)-N-(4-naphthalen-1-ylphenyl)aniline
CID 170138007
N-(2-carbazol-9-ylphenyl)-2-(9,9-dimethylfluoren-4-yl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 170138005
N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-1-amine;N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-2-ylfluoren-1-amine;N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
CID 159322510
N-(9,9-dimethylfluoren-1-yl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzothiol-8-amine
CID 166028610
N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9-phenyl-N-(3-phenylphenyl)carbazol-4-amine
CID 168809354
9,9-dimethyl-N-(2-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]fluoren-1-amine
CID 166938674
N-(9,9-dimethylfluoren-1-yl)-N-[4-(9-phenylcarbazol-4-yl)phenyl]phenanthren-3-amine
CID 121358497
N-[4-[4-(11,11-dimethylindeno[1,2-b]carbazol-5-yl)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 66585289
N-(3-carbazol-9-ylphenyl)-11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-2-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenylbenzo[h]fluoren-1-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(3-phenylphenyl)benzo[h]fluoren-1-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(4-phenylphenyl)benzo[h]fluoren-1-amine
CID 165109640

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
The IUPAC name of N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine (CID 168809293) is N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine.
What is the SMILES notation for N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
The canonical SMILES for N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine is CC1(C)c2ccccc2-c2cccc(N(c3ccc(-c4ccccc4)cc3)c3ccccc3-c3c(-n4c5ccccc5c5ccccc54)ccc4ccccc34)c21.
What is the InChIKey of N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
The InChIKey is ANZLVADHLUCGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H40N2/c1-55(2)47-26-12-8-21-42(47)45-25-16-30-52(54(45)55)56(40-34-31-38(32-35-40)37-17-4-3-5-18-37)50-29-15-11-24-46(50)53-41-20-7-6-19-39(41)33-36-51(53)57-48-27-13-9-22-43(48)44-23-10-14-28-49(44)57/h3-36H,1-2H3.
What are the key properties of N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine?
N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine has a molecular weight of 728.94 g/mol, XLogP of 15.05, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-carbazol-9-ylnaphthalen-1-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine is sourced from PubChem (CID 168809293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).