9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine

C115H84N4 — CID 160882230

IUPAC9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4ccccc4)cc3)c3cccc4ccccc34)cc21.Cc1ccc2c(c1)c1cc(-c3ccc4cc(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6ccccc6-7)c6cccc7ccccc67)cc5)ccc4c3)ccc1n2-c1ccccc1
InChIInChI=1S/C60H44N2.C55H40N2/c1-39-20-32-58-53(34-39)54-37-46(27-33-59(54)62(58)47-14-5-4-6-15-47)45-24-23-43-35-42(21-22-44(43)36-45)40-25-28-48(29-26-40)61(57-19-11-13-41-12-7-8-16-50(41)57)49-30-31-52-51-17-9-10-18-55(51)60(2,3)56(52)38-49;1-55(2)50-22-12-11-21-46(50)47-31-30-44(36-51(47)55)56(52-23-13-17-39-16-9-10-20-45(39)52)43-28-24-38(25-29-43)41-27-33-54-49(35-41)48-34-40(37-14-5-3-6-15-37)26-32-53(48)57(54)42-18-7-4-8-19-42/h4-38H,1-3H3;3-36H,1-2H3
InChIKeySNELEAREYBHJBR-UHFFFAOYSA-N
MW1521.96 g/mol
LogP31.56
Rot. Bonds12

About 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine

9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine (PubChem CID 160882230) has the molecular formula C115H84N4 and a molecular weight of 1521.96 g/mol. Its IUPAC name is 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
PubChem CID160882230
Molecular FormulaC115H84N4
Molecular Weight1521.96 g/mol
Exact Mass1520.67
IUPAC Name9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4ccccc4)cc3)c3cccc4ccccc34)cc21.Cc1ccc2c(c1)c1cc(-c3ccc4cc(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6ccccc6-7)c6cccc7ccccc67)cc5)ccc4c3)ccc1n2-c1ccccc1
InChIInChI=1S/C60H44N2.C55H40N2/c1-39-20-32-58-53(34-39)54-37-46(27-33-59(54)62(58)47-14-5-4-6-15-47)45-24-23-43-35-42(21-22-44(43)36-45)40-25-28-48(29-26-40)61(57-19-11-13-41-12-7-8-16-50(41)57)49-30-31-52-51-17-9-10-18-55(51)60(2,3)56(52)38-49;1-55(2)50-22-12-11-21-46(50)47-31-30-44(36-51(47)55)56(52-23-13-17-39-16-9-10-20-45(39)52)43-28-24-38(25-29-43)41-27-33-54-49(35-41)48-34-40(37-14-5-3-6-15-37)26-32-53(48)57(54)42-18-7-4-8-19-42/h4-38H,1-3H3;3-36H,1-2H3
InChIKeySNELEAREYBHJBR-UHFFFAOYSA-N
XLogP31.56
TPSA16.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms119
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001521.96
LogP ≤ 531.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine (CID 160882230) is 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4ccccc4)cc3)c3cccc4ccccc34)cc21.Cc1ccc2c(c1)c1cc(-c3ccc4cc(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6ccccc6-7)c6cccc7ccccc67)cc5)ccc4c3)ccc1n2-c1ccccc1.
What is the InChIKey of 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
The InChIKey is SNELEAREYBHJBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H44N2.C55H40N2/c1-39-20-32-58-53(34-39)54-37-46(27-33-59(54)62(58)47-14-5-4-6-15-47)45-24-23-43-35-42(21-22-44(43)36-45)40-25-28-48(29-26-40)61(57-19-11-13-41-12-7-8-16-50(41)57)49-30-31-52-51-17-9-10-18-55(51)60(2,3)56(52)38-49;1-55(2)50-22-12-11-21-46(50)47-31-30-44(36-51(47)55)56(52-23-13-17-39-16-9-10-20-45(39)52)43-28-24-38(25-29-43)41-27-33-54-49(35-41)48-34-40(37-14-5-3-6-15-37)26-32-53(48)57(54)42-18-7-4-8-19-42/h4-38H,1-3H3;3-36H,1-2H3.
What are the key properties of 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine has a molecular weight of 1521.96 g/mol, XLogP of 31.56, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-[4-[6-(6-methyl-9-phenylcarbazol-3-yl)naphthalen-2-yl]phenyl]-N-naphthalen-1-ylfluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine is sourced from PubChem (CID 160882230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).