9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole

C54H34N2 — CID 59169289

IUPAC9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole
SMILESc1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)ccc(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)c2c1
InChIInChI=1S/C54H34N2/c1-2-14-41-40(13-1)39(37-26-25-36-34-38(28-27-35(36)33-37)55-50-21-9-5-17-46(50)47-18-6-10-22-51(47)55)29-30-43(41)44-31-32-54(45-16-4-3-15-42(44)45)56-52-23-11-7-19-48(52)49-20-8-12-24-53(49)56/h1-34H
InChIKeyICMPNRORTQGASL-UHFFFAOYSA-N
MW710.88 g/mol
LogP14.67
Rot. Bonds4

About 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole

9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole (PubChem CID 59169289) has the molecular formula C54H34N2 and a molecular weight of 710.88 g/mol. Its IUPAC name is 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole.

Molecular Properties

Compound Name9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole
PubChem CID59169289
Molecular FormulaC54H34N2
Molecular Weight710.88 g/mol
Exact Mass710.27
IUPAC Name9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole
SMILESc1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)ccc(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)c2c1
InChIInChI=1S/C54H34N2/c1-2-14-41-40(13-1)39(37-26-25-36-34-38(28-27-35(36)33-37)55-50-21-9-5-17-46(50)47-18-6-10-22-51(47)55)29-30-43(41)44-31-32-54(45-16-4-3-15-42(44)45)56-52-23-11-7-19-48(52)49-20-8-12-24-53(49)56/h1-34H
InChIKeyICMPNRORTQGASL-UHFFFAOYSA-N
XLogP14.67
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500710.88
LogP ≤ 514.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 159264413
9-[4-[5-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[6-[5-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-2-yl]carbazole;1-methoxy-4-[5-(6-methoxynaphthalen-2-yl)naphthalen-1-yl]naphthalene
CID 159134431
9-[4-[3-[4-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]phenyl]naphthalen-1-yl]carbazole;9-[6-[3-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-2-yl]phenyl]naphthalen-2-yl]carbazole;9-[6-[3-[6-(4,6-diphenyl-2-pyridinyl)naphthalen-2-yl]phenyl]naphthalen-2-yl]carbazole;9-[4-[3-[4-[3-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole;9-[4-[3-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 159321750
6-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-2-[9-(4-naphthalen-2-ylnaphthalen-1-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420798
3-[9-(7-fluoranthen-3-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-fluoranthen-3-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-triphenylen-2-ylnaphthalen-1-yl)carbazole;3-(9-phenylcarbazol-3-yl)-9-(6-triphenylen-2-ylnaphthalen-2-yl)carbazole
CID 158215347
2-(2-methylphenyl)-9-[4-[2-(2-methylphenyl)carbazol-9-yl]naphthalen-1-yl]carbazole;2-naphthalen-1-yl-9-[6-(2-naphthalen-1-ylcarbazol-9-yl)naphthalen-2-yl]carbazole;2-phenyl-9-[4-(2-phenylcarbazol-9-yl)naphthalen-1-yl]carbazole
CID 159193683
11-(4-phenylnaphthalen-1-yl)-5-(4-phenylphenyl)indolo[3,2-b]carbazole
CID 167029799
3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 158707626
9-[4-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]carbazole;9-[4-[4-(4-carbazol-9-ylnaphthalen-1-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole;9-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]carbazole
CID 159108089
9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole
CID 58971525
6-[9-(4-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylnaphthalen-1-yl)carbazol-3-yl]-2-[9-(6-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420634
9-[4-[4-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)phenyl]naphthalen-1-yl]carbazole
CID 58971540

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole?
The IUPAC name of 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole (CID 59169289) is 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole.
What is the SMILES notation for 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole?
The canonical SMILES for 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole is c1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)ccc(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)c2c1.
What is the InChIKey of 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole?
The InChIKey is ICMPNRORTQGASL-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N2/c1-2-14-41-40(13-1)39(37-26-25-36-34-38(28-27-35(36)33-37)55-50-21-9-5-17-46(50)47-18-6-10-22-51(47)55)29-30-43(41)44-31-32-54(45-16-4-3-15-42(44)45)56-52-23-11-7-19-48(52)49-20-8-12-24-53(49)56/h1-34H.
What are the key properties of 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole?
9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole has a molecular weight of 710.88 g/mol, XLogP of 14.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-(6-carbazol-9-ylnaphthalen-2-yl)naphthalen-1-yl]naphthalen-1-yl]carbazole is sourced from PubChem (CID 59169289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).