7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine

C62H42N2 — CID 169285240

IUPAC7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine
SMILESc1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cccc5cccc(-c6ccccc6)c45)cc3)c3cccc4c3c3c5ccccc5ccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C62H42N2/c1-4-17-43(18-5-1)44-33-35-47(36-34-44)52-26-12-13-30-56(52)63(51-40-37-48(38-41-51)54-29-15-23-49-22-14-28-53(60(49)54)45-19-6-2-7-20-45)57-31-16-32-58-62(57)61-55-27-11-10-21-46(55)39-42-59(61)64(58)50-24-8-3-9-25-50/h1-42H
InChIKeyYUPWGUUGOFBTIG-UHFFFAOYSA-N
MW815.03 g/mol
LogP17.23
Rot. Bonds8

About 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine

7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine (PubChem CID 169285240) has the molecular formula C62H42N2 and a molecular weight of 815.03 g/mol. Its IUPAC name is 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine.

Molecular Properties

Compound Name7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine
PubChem CID169285240
Molecular FormulaC62H42N2
Molecular Weight815.03 g/mol
Exact Mass814.33
IUPAC Name7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine
SMILESc1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cccc5cccc(-c6ccccc6)c45)cc3)c3cccc4c3c3c5ccccc5ccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C62H42N2/c1-4-17-43(18-5-1)44-33-35-47(36-34-44)52-26-12-13-30-56(52)63(51-40-37-48(38-41-51)54-29-15-23-49-22-14-28-53(60(49)54)45-19-6-2-7-20-45)57-31-16-32-58-62(57)61-55-27-11-10-21-46(55)39-42-59(61)64(58)50-24-8-3-9-25-50/h1-42H
InChIKeyYUPWGUUGOFBTIG-UHFFFAOYSA-N
XLogP17.23
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500815.03
LogP ≤ 517.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-phenyl-N-[2-(9-phenylfluoren-9-yl)phenyl]-N-[4-(8-phenylnaphthalen-1-yl)phenyl]benzo[c]carbazol-11-amine
CID 169285541
N-(4-benzo[c]carbazol-7-ylphenyl)-N,2-bis(4-phenylphenyl)aniline
CID 167038136
N,4-diphenyl-N-[4-(11-phenylbenzo[c]carbazol-7-yl)phenyl]aniline
CID 177101209
N-(4-naphthalen-1-ylphenyl)-9-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]carbazol-4-amine
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N-(4-benzo[c]phenanthren-1-ylphenyl)-9-phenyl-N-(2-phenylphenyl)carbazol-1-amine
CID 167182149
N,2-diphenyl-N-[4-[8-(9-phenylcarbazol-3-yl)naphthalen-1-yl]phenyl]aniline
CID 169016116
N-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-4-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170303156
N-(4-naphthalen-1-ylphenyl)-3-(7-phenylbenzo[c]carbazol-11-yl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167196262
N-(4-naphthalen-1-ylphenyl)-2-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167196149
N-(4-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-3-(7-phenylbenzo[c]carbazol-11-yl)aniline
CID 166660520
N-(4-naphthalen-1-ylphenyl)-7-phenyl-N-(2-phenylphenyl)benzo[c]carbazol-10-amine
CID 166847541
7-phenyl-N-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[c]carbazol-2-amine
CID 155034262

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine?
The IUPAC name of 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine (CID 169285240) is 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine.
What is the SMILES notation for 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine?
The canonical SMILES for 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine is c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cccc5cccc(-c6ccccc6)c45)cc3)c3cccc4c3c3c5ccccc5ccc3n4-c3ccccc3)cc2)cc1.
What is the InChIKey of 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine?
The InChIKey is YUPWGUUGOFBTIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H42N2/c1-4-17-43(18-5-1)44-33-35-47(36-34-44)52-26-12-13-30-56(52)63(51-40-37-48(38-41-51)54-29-15-23-49-22-14-28-53(60(49)54)45-19-6-2-7-20-45)57-31-16-32-58-62(57)61-55-27-11-10-21-46(55)39-42-59(61)64(58)50-24-8-3-9-25-50/h1-42H.
What are the key properties of 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine?
7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine has a molecular weight of 815.03 g/mol, XLogP of 17.23, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]benzo[c]carbazol-11-amine is sourced from PubChem (CID 169285240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).