N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine

C115H77N7 — CID 164973496

IUPACN-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c(c5)Cc5ccccc5-6)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1
InChIInChI=1S/C60H40N4.C55H37N3/c1-4-16-43(17-5-1)62-57-27-15-12-24-51(57)54-38-42(30-37-58(54)62)41-28-31-46(32-29-41)61(47-33-35-52-49-22-10-13-25-55(49)63(59(52)39-47)44-18-6-2-7-19-44)48-34-36-53-50-23-11-14-26-56(50)64(60(53)40-48)45-20-8-3-9-21-45;1-3-14-41(15-4-1)57-53-22-12-10-20-49(53)51-35-38(25-32-54(51)57)37-23-26-43(27-24-37)56(44-28-30-47-40(34-44)33-39-13-7-8-18-46(39)47)45-29-31-50-48-19-9-11-21-52(48)58(55(50)36-45)42-16-5-2-6-17-42/h1-40H;1-32,34-36H,33H2
InChIKeyDLHSAEDAMCXZSY-UHFFFAOYSA-N
MW1556.93 g/mol
LogP30.70
Rot. Bonds13

About N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine

N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine (PubChem CID 164973496) has the molecular formula C115H77N7 and a molecular weight of 1556.93 g/mol. Its IUPAC name is N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine.

Molecular Properties

Compound NameN-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine
PubChem CID164973496
Molecular FormulaC115H77N7
Molecular Weight1556.93 g/mol
Exact Mass1555.62
IUPAC NameN-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c(c5)Cc5ccccc5-6)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1
InChIInChI=1S/C60H40N4.C55H37N3/c1-4-16-43(17-5-1)62-57-27-15-12-24-51(57)54-38-42(30-37-58(54)62)41-28-31-46(32-29-41)61(47-33-35-52-49-22-10-13-25-55(49)63(59(52)39-47)44-18-6-2-7-19-44)48-34-36-53-50-23-11-14-26-56(50)64(60(53)40-48)45-20-8-3-9-21-45;1-3-14-41(15-4-1)57-53-22-12-10-20-49(53)51-35-38(25-32-54(51)57)37-23-26-43(27-24-37)56(44-28-30-47-40(34-44)33-39-13-7-8-18-46(39)47)45-29-31-50-48-19-9-11-21-52(48)58(55(50)36-45)42-16-5-2-6-17-42/h1-40H;1-32,34-36H,33H2
InChIKeyDLHSAEDAMCXZSY-UHFFFAOYSA-N
XLogP30.70
TPSA31.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms122
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001556.93
LogP ≤ 530.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine?
The IUPAC name of N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine (CID 164973496) is N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine.
What is the SMILES notation for N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine?
The canonical SMILES for N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine is c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c(c5)Cc5ccccc5-6)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1.
What is the InChIKey of N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine?
The InChIKey is DLHSAEDAMCXZSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N4.C55H37N3/c1-4-16-43(17-5-1)62-57-27-15-12-24-51(57)54-38-42(30-37-58(54)62)41-28-31-46(32-29-41)61(47-33-35-52-49-22-10-13-25-55(49)63(59(52)39-47)44-18-6-2-7-19-44)48-34-36-53-50-23-11-14-26-56(50)64(60(53)40-48)45-20-8-3-9-21-45;1-3-14-41(15-4-1)57-53-22-12-10-20-49(53)51-35-38(25-32-54(51)57)37-23-26-43(27-24-37)56(44-28-30-47-40(34-44)33-39-13-7-8-18-46(39)47)45-29-31-50-48-19-9-11-21-52(48)58(55(50)36-45)42-16-5-2-6-17-42/h1-40H;1-32,34-36H,33H2.
What are the key properties of N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine?
N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine has a molecular weight of 1556.93 g/mol, XLogP of 30.70, 13 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine is sourced from PubChem (CID 164973496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).