4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne

C150H90N6 — CID 165014614

IUPAC4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne
SMILESC#CC#CC#CC#CC#CC#CC#C.c1ccc(-c2ccc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)c2)cc1.c1ccc2cc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)ccc2c1
InChIInChI=1S/2C46H30N2.C44H28N2.C14H2/c1-2-13-31(14-3-1)34-17-10-18-35(29-34)47-41-23-8-6-19-39(41)45-37(21-11-25-43(45)47)38-22-12-26-44-46(38)40-20-7-9-24-42(40)48(44)36-28-27-32-15-4-5-16-33(32)30-36;1-2-12-31(13-3-1)33-24-27-35(28-25-33)47-41-20-8-6-16-39(41)45-37(18-10-22-43(45)47)38-19-11-23-44-46(38)40-17-7-9-21-42(40)48(44)36-29-26-32-14-4-5-15-34(32)30-36;1-3-13-31-27-33(25-23-29(31)11-1)45-39-19-7-5-15-37(39)43-35(17-9-21-41(43)45)36-18-10-22-42-44(36)38-16-6-8-20-40(38)46(42)34-26-24-30-12-2-4-14-32(30)28-34;1-3-5-7-9-11-13-14-12-10-8-6-4-2/h2*1-30H;1-28H;1-2H
InChIKeyKFPRKWKLZNNKAB-UHFFFAOYSA-N
MW1976.41 g/mol
LogP36.86
Rot. Bonds11

About 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne

4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne (PubChem CID 165014614) has the molecular formula C150H90N6 and a molecular weight of 1976.41 g/mol. Its IUPAC name is 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne.

Molecular Properties

Compound Name4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne
PubChem CID165014614
Molecular FormulaC150H90N6
Molecular Weight1976.41 g/mol
Exact Mass1974.72
IUPAC Name4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne
SMILESC#CC#CC#CC#CC#CC#CC#C.c1ccc(-c2ccc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)c2)cc1.c1ccc2cc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)ccc2c1
InChIInChI=1S/2C46H30N2.C44H28N2.C14H2/c1-2-13-31(14-3-1)34-17-10-18-35(29-34)47-41-23-8-6-19-39(41)45-37(21-11-25-43(45)47)38-22-12-26-44-46(38)40-20-7-9-24-42(40)48(44)36-28-27-32-15-4-5-16-33(32)30-36;1-2-12-31(13-3-1)33-24-27-35(28-25-33)47-41-20-8-6-16-39(41)45-37(18-10-22-43(45)47)38-19-11-23-44-46(38)40-17-7-9-21-42(40)48(44)36-29-26-32-14-4-5-15-34(32)30-36;1-3-13-31-27-33(25-23-29(31)11-1)45-39-19-7-5-15-37(39)43-35(17-9-21-41(43)45)36-18-10-22-42-44(36)38-16-6-8-20-40(38)46(42)34-26-24-30-12-2-4-14-32(30)28-34;1-3-5-7-9-11-13-14-12-10-8-6-4-2/h2*1-30H;1-28H;1-2H
InChIKeyKFPRKWKLZNNKAB-UHFFFAOYSA-N
XLogP36.86
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms156
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001976.41
LogP ≤ 536.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne?
The IUPAC name of 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne (CID 165014614) is 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne.
What is the SMILES notation for 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne?
The canonical SMILES for 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne is C#CC#CC#CC#CC#CC#CC#C.c1ccc(-c2ccc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)c2)cc1.c1ccc2cc(-n3c4ccccc4c4c(-c5cccc6c5c5ccccc5n6-c5ccc6ccccc6c5)cccc43)ccc2c1.
What is the InChIKey of 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne?
The InChIKey is KFPRKWKLZNNKAB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C46H30N2.C44H28N2.C14H2/c1-2-13-31(14-3-1)34-17-10-18-35(29-34)47-41-23-8-6-19-39(41)45-37(21-11-25-43(45)47)38-22-12-26-44-46(38)40-20-7-9-24-42(40)48(44)36-28-27-32-15-4-5-16-33(32)30-36;1-2-12-31(13-3-1)33-24-27-35(28-25-33)47-41-20-8-6-16-39(41)45-37(18-10-22-43(45)47)38-19-11-23-44-46(38)40-17-7-9-21-42(40)48(44)36-29-26-32-14-4-5-15-34(32)30-36;1-3-13-31-27-33(25-23-29(31)11-1)45-39-19-7-5-15-37(39)43-35(17-9-21-41(43)45)36-18-10-22-42-44(36)38-16-6-8-20-40(38)46(42)34-26-24-30-12-2-4-14-32(30)28-34;1-3-5-7-9-11-13-14-12-10-8-6-4-2/h2*1-30H;1-28H;1-2H.
What are the key properties of 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne?
4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne has a molecular weight of 1976.41 g/mol, XLogP of 36.86, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(3-phenylphenyl)carbazole;4-(9-naphthalen-2-ylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-4-(9-naphthalen-2-ylcarbazol-4-yl)carbazole;tetradeca-1,3,5,7,9,11,13-heptayne is sourced from PubChem (CID 165014614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).