N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine

C60H43N5 — CID 164745189

IUPACN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)n(-c4ccccc4)c4nc6c(c7ccccc7n6-c6ccccc6)n54)cc3)cc21
InChIInChI=1S/C60H43N5/c1-60(2)52-24-14-12-22-49(52)50-36-30-43(38-53(50)60)42-28-33-47(34-29-42)62(46-31-26-41(27-32-46)40-16-6-3-7-17-40)48-35-37-55-56(39-48)64(45-20-10-5-11-21-45)59-61-58-57(65(55)59)51-23-13-15-25-54(51)63(58)44-18-8-4-9-19-44/h3-39H,1-2H3
InChIKeyWTCLDZLKCRWFQS-UHFFFAOYSA-N
MW834.04 g/mol
LogP15.49
Rot. Bonds7

About N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine

N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine (PubChem CID 164745189) has the molecular formula C60H43N5 and a molecular weight of 834.04 g/mol. Its IUPAC name is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine.

Molecular Properties

Compound NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine
PubChem CID164745189
Molecular FormulaC60H43N5
Molecular Weight834.04 g/mol
Exact Mass833.35
IUPAC NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)n(-c4ccccc4)c4nc6c(c7ccccc7n6-c6ccccc6)n54)cc3)cc21
InChIInChI=1S/C60H43N5/c1-60(2)52-24-14-12-22-49(52)50-36-30-43(38-53(50)60)42-28-33-47(34-29-42)62(46-31-26-41(27-32-46)40-16-6-3-7-17-40)48-35-37-55-56(39-48)64(45-20-10-5-11-21-45)59-61-58-57(65(55)59)51-23-13-15-25-54(51)63(58)44-18-8-4-9-19-44/h3-39H,1-2H3
InChIKeyWTCLDZLKCRWFQS-UHFFFAOYSA-N
XLogP15.49
TPSA30.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500834.04
LogP ≤ 515.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine with MolForge

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Related Compounds

9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]fluoren-2-amine;9,9-dimethyl-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 159828144
N-[4-[6-(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-yl]phenyl]-N,4-diphenylaniline
CID 167527113
N-(9,9-dimethylfluoren-2-yl)-5-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)benzimidazolo[1,2-a]benzimidazol-2-amine
CID 155766482
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;propane
CID 145262951
9,9-dimethyl-N-[4-[5-(9-phenylcarbazol-3-yl)benzimidazolo[1,2-a]benzimidazol-2-yl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 155766506
N-[9,9-dimethyl-7-(9-phenylcarbazol-3-yl)fluoren-2-yl]-9,9-dimethyl-7-(9-phenylcarbazol-3-yl)-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 87412305
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-(9-phenylcarbazol-3-yl)-N-(3-phenylphenyl)fluoren-2-amine
CID 59171718
N-[4-[4-(benzimidazolo[1,2-a]benzimidazol-5-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 139479683
9,9-dimethyl-N-(4-phenylphenyl)-N-[4-[9-[3-[9-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]carbazol-3-yl]phenyl]carbazol-3-yl]phenyl]fluoren-2-amine
CID 167287563
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;9-N,9-N,10-N,10-N-tetraphenylanthracene-9,10-diamine
CID 159845572
carbanide;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;molecular hydrogen;vanadium
CID 158521255
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(3-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-phenyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine
CID 159095793

Frequently Asked Questions

What is the IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine?
The IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine (CID 164745189) is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine.
What is the SMILES notation for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine?
The canonical SMILES for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine is CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)n(-c4ccccc4)c4nc6c(c7ccccc7n6-c6ccccc6)n54)cc3)cc21.
What is the InChIKey of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine?
The InChIKey is WTCLDZLKCRWFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H43N5/c1-60(2)52-24-14-12-22-49(52)50-36-30-43(38-53(50)60)42-28-33-47(34-29-42)62(46-31-26-41(27-32-46)40-16-6-3-7-17-40)48-35-37-55-56(39-48)64(45-20-10-5-11-21-45)59-61-58-57(65(55)59)51-23-13-15-25-54(51)63(58)44-18-8-4-9-19-44/h3-39H,1-2H3.
What are the key properties of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine?
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine has a molecular weight of 834.04 g/mol, XLogP of 15.49, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,13-diphenyl-N-(4-phenylphenyl)-1,9,11,13-tetrazapentacyclo[10.7.0.02,10.03,8.014,19]nonadeca-2(10),3,5,7,11,14(19),15,17-octaen-16-amine is sourced from PubChem (CID 164745189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).