N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine

C50H41NO — CID 176836119

IUPACN-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine
SMILESCc1ccc2c(c1)C(C)(C)c1c-2ccc(C)c1N(c1ccc(-c2ccc3oc4ccccc4c3c2)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C50H41NO/c1-30-15-23-38-40-24-16-31(2)48(47(40)50(5,6)43(38)27-30)51(35-22-25-37-36-11-7-9-13-42(36)49(3,4)44(37)29-35)34-20-17-32(18-21-34)33-19-26-46-41(28-33)39-12-8-10-14-45(39)52-46/h7-29H,1-6H3
InChIKeyCHUYOXUWEUFMLR-UHFFFAOYSA-N
MW671.88 g/mol
LogP13.95
Rot. Bonds4

About N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine

N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine (PubChem CID 176836119) has the molecular formula C50H41NO and a molecular weight of 671.88 g/mol. Its IUPAC name is N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine
PubChem CID176836119
Molecular FormulaC50H41NO
Molecular Weight671.88 g/mol
Exact Mass671.32
IUPAC NameN-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine
SMILESCc1ccc2c(c1)C(C)(C)c1c-2ccc(C)c1N(c1ccc(-c2ccc3oc4ccccc4c3c2)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C50H41NO/c1-30-15-23-38-40-24-16-31(2)48(47(40)50(5,6)43(38)27-30)51(35-22-25-37-36-11-7-9-13-42(36)49(3,4)44(37)29-35)34-20-17-32(18-21-34)33-19-26-46-41(28-33)39-12-8-10-14-45(39)52-46/h7-29H,1-6H3
InChIKeyCHUYOXUWEUFMLR-UHFFFAOYSA-N
XLogP13.95
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500671.88
LogP ≤ 513.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine with MolForge

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-[4-[4-(4-methylphenyl)phenyl]phenyl]fluoren-2-amine
CID 67964272
N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 67964274
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-7-phenylfluoren-2-amine
CID 67964328
4-(4-dibenzofuran-2-ylphenyl)-N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]aniline
CID 67964226
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 70808823
N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline
CID 158947437
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine
CID 118146115
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2'-yl)phenyl]-9,9-dimethylfluoren-2-amine
CID 146247470
N-[4-(4-dibenzofuran-2-ylphenyl)naphthalen-1-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 67964245
7-dibenzofuran-2-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;7-dibenzofuran-2-yl-9,9-dimethyl-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 157073472
7-dibenzofuran-2-yl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-dibenzofuran-3-yl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 160626252
N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-7-phenylfluoren-2-amine;N,N-bis(4-dibenzofuran-2-ylphenyl)-4-(4-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 159396574

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine?
The IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine (CID 176836119) is N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine.
What is the SMILES notation for N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine?
The canonical SMILES for N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine is Cc1ccc2c(c1)C(C)(C)c1c-2ccc(C)c1N(c1ccc(-c2ccc3oc4ccccc4c3c2)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine?
The InChIKey is CHUYOXUWEUFMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H41NO/c1-30-15-23-38-40-24-16-31(2)48(47(40)50(5,6)43(38)27-30)51(35-22-25-37-36-11-7-9-13-42(36)49(3,4)44(37)29-35)34-20-17-32(18-21-34)33-19-26-46-41(28-33)39-12-8-10-14-45(39)52-46/h7-29H,1-6H3.
What are the key properties of N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine?
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine has a molecular weight of 671.88 g/mol, XLogP of 13.95, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-2,7,9,9-tetramethylfluoren-1-amine is sourced from PubChem (CID 176836119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).