N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine

C63H58N2 — CID 170543205

IUPACN,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine
SMILESCC1(C)c2cc(N(c3ccc(C4CCCCC4)cc3)c3ccc(C4CCCCC4)cc3)ccc2-c2c(-c3ccccc3)cc3c4cc(-c5ccccc5)ccc4n(-c4ccccc4)c3c21
InChIInChI=1S/C63H58N2/c1-63(2)58-41-53(64(51-33-28-46(29-34-51)43-18-8-3-9-19-43)52-35-30-47(31-36-52)44-20-10-4-11-21-44)37-38-54(58)60-55(48-24-14-6-15-25-48)42-57-56-40-49(45-22-12-5-13-23-45)32-39-59(56)65(62(57)61(60)63)50-26-16-7-17-27-50/h5-7,12-17,22-44H,3-4,8-11,18-21H2,1-2H3
InChIKeyIHCVTIRXQWSHDB-UHFFFAOYSA-N
MW843.17 g/mol
LogP17.99
Rot. Bonds8

About N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine

N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine (PubChem CID 170543205) has the molecular formula C63H58N2 and a molecular weight of 843.17 g/mol. Its IUPAC name is N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine.

Molecular Properties

Compound NameN,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine
PubChem CID170543205
Molecular FormulaC63H58N2
Molecular Weight843.17 g/mol
Exact Mass842.46
IUPAC NameN,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine
SMILESCC1(C)c2cc(N(c3ccc(C4CCCCC4)cc3)c3ccc(C4CCCCC4)cc3)ccc2-c2c(-c3ccccc3)cc3c4cc(-c5ccccc5)ccc4n(-c4ccccc4)c3c21
InChIInChI=1S/C63H58N2/c1-63(2)58-41-53(64(51-33-28-46(29-34-51)43-18-8-3-9-19-43)52-35-30-47(31-36-52)44-20-10-4-11-21-44)37-38-54(58)60-55(48-24-14-6-15-25-48)42-57-56-40-49(45-22-12-5-13-23-45)32-39-59(56)65(62(57)61(60)63)50-26-16-7-17-27-50/h5-7,12-17,22-44H,3-4,8-11,18-21H2,1-2H3
InChIKeyIHCVTIRXQWSHDB-UHFFFAOYSA-N
XLogP17.99
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500843.17
LogP ≤ 517.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine with MolForge

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Related Compounds

N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-8,11-diphenylindeno[2,1-a]carbazol-2-amine
CID 170543002
N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-2,5-diphenylindeno[1,2-c]carbazol-10-amine
CID 170543277
N-[4-(1-adamantyl)phenyl]-N-(4-cyclohexylphenyl)-12,12-dimethyl-4,8,11-triphenylindeno[2,1-a]carbazol-2-amine
CID 170543241
N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-7,11-diphenylindeno[2,1-a]carbazol-2-amine
CID 170543157
N,N-bis(4-cyclohexylphenyl)-9,9-dimethyl-5-(4-phenylphenyl)fluoren-2-amine
CID 168738594
N-(4-cyclohexylphenyl)-9,9-dimethyl-N-[4-[2-phenyl-6-(3-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 168771754
9,9-dimethyl-5-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 155153906
N-[4-(4-cyclohexylphenyl)phenyl]-8-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 171439072
N,N-bis[4-(1-adamantyl)phenyl]-12,12-dimethyl-8,11-diphenylindeno[2,1-a]carbazol-2-amine
CID 170543272
9,9-dimethyl-N-(4-phenylphenyl)-N-[4-[4-(1,3,6-triphenylcarbazol-9-yl)phenyl]phenyl]fluoren-2-amine
CID 121445598
N-(4-cyclohexylphenyl)-9,9-dimethyl-N-[4-(2,3,5,6-tetraphenylphenyl)phenyl]fluoren-2-amine
CID 168771783
N-[4-(4-cyclohexylphenyl)phenyl]-N-[4-[2,5-diphenyl-4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]phenyl]-9,9-dimethylfluoren-2-amine
CID 176611487

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine?
The IUPAC name of N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine (CID 170543205) is N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine.
What is the SMILES notation for N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine?
The canonical SMILES for N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine is CC1(C)c2cc(N(c3ccc(C4CCCCC4)cc3)c3ccc(C4CCCCC4)cc3)ccc2-c2c(-c3ccccc3)cc3c4cc(-c5ccccc5)ccc4n(-c4ccccc4)c3c21.
What is the InChIKey of N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine?
The InChIKey is IHCVTIRXQWSHDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H58N2/c1-63(2)58-41-53(64(51-33-28-46(29-34-51)43-18-8-3-9-19-43)52-35-30-47(31-36-52)44-20-10-4-11-21-44)37-38-54(58)60-55(48-24-14-6-15-25-48)42-57-56-40-49(45-22-12-5-13-23-45)32-39-59(56)65(62(57)61(60)63)50-26-16-7-17-27-50/h5-7,12-17,22-44H,3-4,8-11,18-21H2,1-2H3.
What are the key properties of N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine?
N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine has a molecular weight of 843.17 g/mol, XLogP of 17.99, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-cyclohexylphenyl)-12,12-dimethyl-5,8,11-triphenylindeno[2,1-a]carbazol-2-amine is sourced from PubChem (CID 170543205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).