9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine

C64H50N2 — CID 177128271

IUPAC9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c5ccccc5n(-c5ccc(-c6ccc(C7CCCCC7)cc6)cc5)c4c3)c3ccc4ccccc4c3-c3ccccc3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C64H50N2/c1-5-17-45(18-6-1)47-29-31-48(32-30-47)49-33-37-54(38-34-49)65-60-28-16-15-27-57(60)58-40-39-55(44-63(58)65)66(62-42-35-51-23-13-14-26-56(51)64(62)52-24-11-4-12-25-52)61-41-36-53(46-19-7-2-8-20-46)43-59(61)50-21-9-3-10-22-50/h2-4,7-16,19-45H,1,5-6,17-18H2
InChIKeyNWLYLUCBYWMMFD-UHFFFAOYSA-N
MW847.12 g/mol
LogP18.12
Rot. Bonds9

About 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine

9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine (PubChem CID 177128271) has the molecular formula C64H50N2 and a molecular weight of 847.12 g/mol. Its IUPAC name is 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine.

Molecular Properties

Compound Name9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
PubChem CID177128271
Molecular FormulaC64H50N2
Molecular Weight847.12 g/mol
Exact Mass846.40
IUPAC Name9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c5ccccc5n(-c5ccc(-c6ccc(C7CCCCC7)cc6)cc5)c4c3)c3ccc4ccccc4c3-c3ccccc3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C64H50N2/c1-5-17-45(18-6-1)47-29-31-48(32-30-47)49-33-37-54(38-34-49)65-60-28-16-15-27-57(60)58-40-39-55(44-63(58)65)66(62-42-35-51-23-13-14-26-56(51)64(62)52-24-11-4-12-25-52)61-41-36-53(46-19-7-2-8-20-46)43-59(61)50-21-9-3-10-22-50/h2-4,7-16,19-45H,1,5-6,17-18H2
InChIKeyNWLYLUCBYWMMFD-UHFFFAOYSA-N
XLogP18.12
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500847.12
LogP ≤ 518.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine
CID 177128422
N-[4-(4-cyclohexylphenyl)phenyl]-9-phenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine
CID 169028788
N-[4-(4-cyclohexylphenyl)-2-phenylphenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-2-yl)naphthalen-1-yl]fluoren-3-amine
CID 164774791
N-(4-carbazol-9-ylphenyl)-4-(4-cyclohexylphenyl)-N-[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 169028413
N-[2-(8-cyclohexylnaphthalen-1-yl)phenyl]-9-phenyl-N-[2-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 170297719
N-[4-[3-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]phenyl]phenyl]-N,1-diphenylnaphthalen-2-amine
CID 176611866
N-[1-(3-carbazol-9-ylphenyl)-6-cyclohexylnaphthalen-2-yl]-9,9-dimethyl-N-naphthalen-2-ylfluoren-3-amine;N-[1-(4-carbazol-9-ylphenyl)naphthalen-2-yl]-N-(4-cyclohexylphenyl)-9,9-dimethylfluoren-3-amine;N-[1-(4-carbazol-9-ylphenyl)naphthalen-2-yl]-N-[4-(4-cyclohexylphenyl)phenyl]-9,9-dimethylfluoren-3-amine
CID 165101345
N-[4-[4-[4-(4-cyclohexyl-N-(4-cyclohexylphenyl)anilino)phenyl]phenyl]phenyl]-N,1-diphenylnaphthalen-2-amine
CID 176611894
N-[1-[9-(3-cyclohexylphenyl)carbazol-3-yl]naphthalen-2-yl]-N-(3,5-dicyclohexylphenyl)-9,9-dimethylfluoren-3-amine;N-(3-cyclohexylphenyl)-N-[1-[9-(4-cyclohexylphenyl)carbazol-3-yl]naphthalen-2-yl]-9,9-dimethylfluoren-3-amine;N-[4-(4-cyclohexylphenyl)phenyl]-9,9-dimethyl-N-[1-(9-phenylcarbazol-2-yl)naphthalen-2-yl]fluoren-3-amine
CID 165072405
N-(2,4-diphenylphenyl)-9-phenyl-N-(9-phenylcarbazol-4-yl)carbazol-2-amine
CID 170286478
N-[1-(3-carbazol-9-ylphenyl)naphthalen-2-yl]-5-cyclohexyl-N-[4-(4-cyclohexylphenyl)phenyl]-9,9-dimethylfluoren-3-amine
CID 164774878
N-(4-phenanthren-2-ylphenyl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172501369

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
The IUPAC name of 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine (CID 177128271) is 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine.
What is the SMILES notation for 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
The canonical SMILES for 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine is c1ccc(-c2ccc(N(c3ccc4c5ccccc5n(-c5ccc(-c6ccc(C7CCCCC7)cc6)cc5)c4c3)c3ccc4ccccc4c3-c3ccccc3)c(-c3ccccc3)c2)cc1.
What is the InChIKey of 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
The InChIKey is NWLYLUCBYWMMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H50N2/c1-5-17-45(18-6-1)47-29-31-48(32-30-47)49-33-37-54(38-34-49)65-60-28-16-15-27-57(60)58-40-39-55(44-63(58)65)66(62-42-35-51-23-13-14-26-56(51)64(62)52-24-11-4-12-25-52)61-41-36-53(46-19-7-2-8-20-46)43-59(61)50-21-9-3-10-22-50/h2-4,7-16,19-45H,1,5-6,17-18H2.
What are the key properties of 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine has a molecular weight of 847.12 g/mol, XLogP of 18.12, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine is sourced from PubChem (CID 177128271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).