9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine

C61H42N2 — CID 167214978

IUPAC9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C61H42N2/c1-5-18-43(19-6-1)45-32-35-50(36-33-45)62(51-27-17-22-46(40-51)44-20-7-2-8-21-44)52-37-39-60-56(42-52)55-41-48(34-38-59(55)63(60)49-25-11-4-12-26-49)61(47-23-9-3-10-24-47)57-30-15-13-28-53(57)54-29-14-16-31-58(54)61/h1-42H
InChIKeyVOFNHDZUBUVHJP-UHFFFAOYSA-N
MW803.02 g/mol
LogP15.95
Rot. Bonds8

About 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine

9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine (PubChem CID 167214978) has the molecular formula C61H42N2 and a molecular weight of 803.02 g/mol. Its IUPAC name is 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

Compound Name9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
PubChem CID167214978
Molecular FormulaC61H42N2
Molecular Weight803.02 g/mol
Exact Mass802.33
IUPAC Name9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C61H42N2/c1-5-18-43(19-6-1)45-32-35-50(36-33-45)62(51-27-17-22-46(40-51)44-20-7-2-8-21-44)52-37-39-60-56(42-52)55-41-48(34-38-59(55)63(60)49-25-11-4-12-26-49)61(47-23-9-3-10-24-47)57-30-15-13-28-53(57)54-29-14-16-31-58(54)61/h1-42H
InChIKeyVOFNHDZUBUVHJP-UHFFFAOYSA-N
XLogP15.95
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500803.02
LogP ≤ 515.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,3-diphenyl-N-[4-[3-(9-phenylfluoren-9-yl)carbazol-9-yl]phenyl]aniline
CID 167214673
9,9-diphenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 167214675
4-phenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-6-[4-(9-phenylfluoren-9-yl)phenyl]carbazol-3-yl]phenyl]aniline
CID 167334212
9-phenyl-7-(9-phenylfluoren-9-yl)-N,N-bis(4-phenylphenyl)carbazol-3-amine
CID 167334078
9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 129264403
N,9-diphenyl-9-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)fluoren-2-amine
CID 122593307
2,3,5,6-tetradeuterio-N,N-bis(4-phenylphenyl)-4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]aniline
CID 167334215
5,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine
CID 169009697
N,9,9-triphenyl-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 90393562
9,9-diphenyl-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(3-phenylphenyl)fluoren-2-amine
CID 118462477
2-N,4-N,9-triphenyl-9-(9-phenylcarbazol-3-yl)-4-N-(3-phenylphenyl)-2-N-(4-phenylphenyl)fluorene-2,4-diamine
CID 118204417
N-(4-carbazol-9-ylphenyl)-N-phenyl-3-[3-(9-phenylfluoren-9-yl)phenyl]aniline
CID 169292999

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
The IUPAC name of 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine (CID 167214978) is 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine.
What is the SMILES notation for 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
The canonical SMILES for 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine is c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3n4-c3ccccc3)cc2)cc1.
What is the InChIKey of 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
The InChIKey is VOFNHDZUBUVHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H42N2/c1-5-18-43(19-6-1)45-32-35-50(36-33-45)62(51-27-17-22-46(40-51)44-20-7-2-8-21-44)52-37-39-60-56(42-52)55-41-48(34-38-59(55)63(60)49-25-11-4-12-26-49)61(47-23-9-3-10-24-47)57-30-15-13-28-53(57)54-29-14-16-31-58(54)61/h1-42H.
What are the key properties of 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine?
9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine has a molecular weight of 803.02 g/mol, XLogP of 15.95, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 167214978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).