N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine

C116H76N6 — CID 163954431

IUPACN-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
SMILESc1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-n4c5ccccc5c5c(-c6ccc7c8cc(-c9cc(N(c%10cccc(-c%11ccccc%11)c%10)c%10ccc%11ccccc%11c%10)cc(-n%10c%11ccccc%11c%11ccccc%11%10)c9)ccc8n(-c8ccccc8)c7c6)cccc54)c3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C116H76N6/c1-5-27-77(28-6-1)81-51-58-92(59-52-81)117(94-60-53-79-31-13-15-33-82(79)66-94)96-68-88(85-56-63-112-106(72-85)103-43-19-23-48-110(103)119(112)90-36-9-3-10-37-90)71-99(75-96)122-111-49-24-20-44-105(111)116-100(45-26-50-114(116)122)87-55-62-104-107-73-86(57-64-113(107)120(115(104)74-87)91-38-11-4-12-39-91)89-69-97(76-98(70-89)121-108-46-21-17-41-101(108)102-42-18-22-47-109(102)121)118(95-61-54-80-32-14-16-34-83(80)67-95)93-40-25-35-84(65-93)78-29-7-2-8-30-78/h1-76H
InChIKeySCCSAKIOWDUVTP-UHFFFAOYSA-N
MW1553.93 g/mol
LogP31.66
Rot. Bonds15

About N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine

N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine (PubChem CID 163954431) has the molecular formula C116H76N6 and a molecular weight of 1553.93 g/mol. Its IUPAC name is N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
PubChem CID163954431
Molecular FormulaC116H76N6
Molecular Weight1553.93 g/mol
Exact Mass1552.61
IUPAC NameN-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
SMILESc1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-n4c5ccccc5c5c(-c6ccc7c8cc(-c9cc(N(c%10cccc(-c%11ccccc%11)c%10)c%10ccc%11ccccc%11c%10)cc(-n%10c%11ccccc%11c%11ccccc%11%10)c9)ccc8n(-c8ccccc8)c7c6)cccc54)c3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C116H76N6/c1-5-27-77(28-6-1)81-51-58-92(59-52-81)117(94-60-53-79-31-13-15-33-82(79)66-94)96-68-88(85-56-63-112-106(72-85)103-43-19-23-48-110(103)119(112)90-36-9-3-10-37-90)71-99(75-96)122-111-49-24-20-44-105(111)116-100(45-26-50-114(116)122)87-55-62-104-107-73-86(57-64-113(107)120(115(104)74-87)91-38-11-4-12-39-91)89-69-97(76-98(70-89)121-108-46-21-17-41-101(108)102-42-18-22-47-109(102)121)118(95-61-54-80-32-14-16-34-83(80)67-95)93-40-25-35-84(65-93)78-29-7-2-8-30-78/h1-76H
InChIKeySCCSAKIOWDUVTP-UHFFFAOYSA-N
XLogP31.66
TPSA26.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms122
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001553.93
LogP ≤ 531.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-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

N-[4-[2-(9-phenylcarbazol-4-yl)carbazol-9-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 118034825
N-(4-naphthalen-2-ylphenyl)-3-(9-phenylcarbazol-4-yl)-N-(4-phenylphenyl)aniline
CID 167195790
3-(7,9-diphenylcarbazol-4-yl)-N-(4-naphthalen-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 166659601
N-(4-phenanthren-2-ylphenyl)-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-2-amine
CID 166659919
5-naphthalen-2-yl-N,9-diphenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 169009775
5-naphthalen-2-yl-9-phenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169010271
N-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 118087581
N-[4-[2-[9-(3-naphthalen-2-yl-5-phenylphenyl)carbazol-3-yl]phenyl]phenyl]-N,3-diphenylaniline
CID 118087598
N-[3-(6,9-diphenylcarbazol-4-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)phenanthren-2-amine
CID 166660445
5-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169010262
bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine
CID 159121295
N-[4-(3,5-diphenylphenyl)phenyl]-3,5-diphenyl-N-[3-[3-(9-phenylcarbazol-4-yl)phenyl]phenyl]aniline
CID 167195663

Frequently Asked Questions

What is the IUPAC name of N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
The IUPAC name of N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine (CID 163954431) is N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine.
What is the SMILES notation for N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
The canonical SMILES for N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine is c1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc(-n4c5ccccc5c5c(-c6ccc7c8cc(-c9cc(N(c%10cccc(-c%11ccccc%11)c%10)c%10ccc%11ccccc%11c%10)cc(-n%10c%11ccccc%11c%11ccccc%11%10)c9)ccc8n(-c8ccccc8)c7c6)cccc54)c3)c3ccc4ccccc4c3)cc2)cc1.
What is the InChIKey of N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
The InChIKey is SCCSAKIOWDUVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C116H76N6/c1-5-27-77(28-6-1)81-51-58-92(59-52-81)117(94-60-53-79-31-13-15-33-82(79)66-94)96-68-88(85-56-63-112-106(72-85)103-43-19-23-48-110(103)119(112)90-36-9-3-10-37-90)71-99(75-96)122-111-49-24-20-44-105(111)116-100(45-26-50-114(116)122)87-55-62-104-107-73-86(57-64-113(107)120(115(104)74-87)91-38-11-4-12-39-91)89-69-97(76-98(70-89)121-108-46-21-17-41-101(108)102-42-18-22-47-109(102)121)118(95-61-54-80-32-14-16-34-83(80)67-95)93-40-25-35-84(65-93)78-29-7-2-8-30-78/h1-76H.
What are the key properties of N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine?
N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine has a molecular weight of 1553.93 g/mol, XLogP of 31.66, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[4-[6-[3-carbazol-9-yl-5-(N-naphthalen-2-yl-3-phenylanilino)phenyl]-9-phenylcarbazol-2-yl]carbazol-9-yl]-5-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine is sourced from PubChem (CID 163954431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).