N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine

C60H62N2 — CID 171416263

IUPACN-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
SMILESCC(C)C1CCC(c2ccc(N(c3ccccc3)c3ccc(C4CCCCC4)cc3)cc2)(c2ccc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)CC1
InChIInChI=1S/C60H62N2/c1-43(2)44-38-40-60(41-39-44,47-26-32-52(33-27-47)61(49-18-10-6-11-19-49)51-30-24-46(25-31-51)45-16-8-5-9-17-45)48-28-34-53(35-29-48)62(50-20-12-7-13-21-50)54-36-37-56-55-22-14-15-23-57(55)59(3,4)58(56)42-54/h6-7,10-15,18-37,42-45H,5,8-9,16-17,38-41H2,1-4H3
InChIKeyQIHOMSSTFSTITR-UHFFFAOYSA-N
MW811.17 g/mol
LogP17.11
Rot. Bonds10

About N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine

N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine (PubChem CID 171416263) has the molecular formula C60H62N2 and a molecular weight of 811.17 g/mol. Its IUPAC name is N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine.

Molecular Properties

Compound NameN-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
PubChem CID171416263
Molecular FormulaC60H62N2
Molecular Weight811.17 g/mol
Exact Mass810.49
IUPAC NameN-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
SMILESCC(C)C1CCC(c2ccc(N(c3ccccc3)c3ccc(C4CCCCC4)cc3)cc2)(c2ccc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)CC1
InChIInChI=1S/C60H62N2/c1-43(2)44-38-40-60(41-39-44,47-26-32-52(33-27-47)61(49-18-10-6-11-19-49)51-30-24-46(25-31-51)45-16-8-5-9-17-45)48-28-34-53(35-29-48)62(50-20-12-7-13-21-50)54-36-37-56-55-22-14-15-23-57(55)59(3,4)58(56)42-54/h6-7,10-15,18-37,42-45H,5,8-9,16-17,38-41H2,1-4H3
InChIKeyQIHOMSSTFSTITR-UHFFFAOYSA-N
XLogP17.11
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500811.17
LogP ≤ 517.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-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-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]cyclohex-3-en-1-yl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 171416148
9,9-dimethyl-N-[4-[1-[4-(N-naphthalen-1-ylanilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-N-phenylfluoren-2-amine
CID 171416198
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
N-(4-tert-butylphenyl)-N-(4-cyclododecylphenyl)-9,9-dimethylfluoren-2-amine
CID 155467214
N-[4-(4-cyclohexylphenyl)phenyl]-N-[4-[4-(3,5-dicyclohexylphenyl)phenyl]phenyl]-9,9-dimethylfluoren-2-amine
CID 155467370
N-[3,5-bis(4-cyclohexylphenyl)phenyl]-N-(4-cyclohexylphenyl)-9,9-dimethylfluoren-2-amine
CID 155467122
9,9-dimethyl-N-[4-(1-phenylcyclohexyl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 174254615
N-(4-cyclohexylphenyl)-9,9-dimethyl-N-[4-(2,3,5,6-tetraphenylphenyl)phenyl]fluoren-2-amine
CID 168771783
N-(4-cycloheptylphenyl)-6-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-phenylfluoren-2-amine
CID 171439085
N-[4-(4-cyclohexylphenyl)phenyl]-N-[4-[4-(3,5-dicyclohexylphenyl)phenyl]-3-methylphenyl]-9,9-dimethylfluoren-2-amine
CID 155467210
7-cyclohexyl-N-[9-(3-cyclohexylphenyl)-9-phenylfluoren-2-yl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 165040410
N-[4-(1-adamantyl)phenyl]-N-(4-cyclohexylphenyl)-6-(9,9-dimethylfluoren-3-yl)-9,9-dimethylfluoren-2-amine
CID 171439076

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
The IUPAC name of N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine (CID 171416263) is N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine.
What is the SMILES notation for N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
The canonical SMILES for N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine is CC(C)C1CCC(c2ccc(N(c3ccccc3)c3ccc(C4CCCCC4)cc3)cc2)(c2ccc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)CC1.
What is the InChIKey of N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
The InChIKey is QIHOMSSTFSTITR-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H62N2/c1-43(2)44-38-40-60(41-39-44,47-26-32-52(33-27-47)61(49-18-10-6-11-19-49)51-30-24-46(25-31-51)45-16-8-5-9-17-45)48-28-34-53(35-29-48)62(50-20-12-7-13-21-50)54-36-37-56-55-22-14-15-23-57(55)59(3,4)58(56)42-54/h6-7,10-15,18-37,42-45H,5,8-9,16-17,38-41H2,1-4H3.
What are the key properties of N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?
N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine has a molecular weight of 811.17 g/mol, XLogP of 17.11, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]-4-propan-2-ylcyclohexyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine is sourced from PubChem (CID 171416263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).