7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine

C56H55NO — CID 174315756

IUPAC7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine
SMILESCc1ccc(-c2cccc3c2oc2c(C)cc(C)cc23)c(N(C2=CC3=C(c4ccccc4C3(C)C)C(C)C2)c2ccc3c(c2)C(C)(C)c2cc(C(C)(C)C)ccc2-3)c1
InChIInChI=1S/C56H55NO/c1-32-19-22-41(42-16-14-17-43-45-26-33(2)25-35(4)52(45)58-53(42)43)50(27-32)57(38-28-34(3)51-44-15-12-13-18-46(44)55(8,9)49(51)31-38)37-21-24-40-39-23-20-36(54(5,6)7)29-47(39)56(10,11)48(40)30-37/h12-27,29-31,34H,28H2,1-11H3
InChIKeyYEUBTAAGWMTBKL-UHFFFAOYSA-N
MW758.06 g/mol
LogP15.59
Rot. Bonds4

About 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine

7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine (PubChem CID 174315756) has the molecular formula C56H55NO and a molecular weight of 758.06 g/mol. Its IUPAC name is 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine.

Molecular Properties

Compound Name7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine
PubChem CID174315756
Molecular FormulaC56H55NO
Molecular Weight758.06 g/mol
Exact Mass757.43
IUPAC Name7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine
SMILESCc1ccc(-c2cccc3c2oc2c(C)cc(C)cc23)c(N(C2=CC3=C(c4ccccc4C3(C)C)C(C)C2)c2ccc3c(c2)C(C)(C)c2cc(C(C)(C)C)ccc2-3)c1
InChIInChI=1S/C56H55NO/c1-32-19-22-41(42-16-14-17-43-45-26-33(2)25-35(4)52(45)58-53(42)43)50(27-32)57(38-28-34(3)51-44-15-12-13-18-46(44)55(8,9)49(51)31-38)37-21-24-40-39-23-20-36(54(5,6)7)29-47(39)56(10,11)48(40)30-37/h12-27,29-31,34H,28H2,1-11H3
InChIKeyYEUBTAAGWMTBKL-UHFFFAOYSA-N
XLogP15.59
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500758.06
LogP ≤ 515.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine with MolForge

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Related Compounds

7-tert-butyl-N-[5-tert-butyl-2-(6-propan-2-yldibenzofuran-4-yl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 174315841
7-tert-butyl-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-(2,4,6-trimethylphenyl)phenyl]fluoren-2-amine
CID 174308002
7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 174315860
7-tert-butyl-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-(3-methylnaphthalen-1-yl)fluoren-2-amine
CID 174309728
9-tert-butyl-N-(7-tert-butyl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-amine
CID 174312490
6-cyclohexyl-N,N-bis(9,9-dimethylfluoren-2-yl)-8-(2,4,6-trimethylphenyl)dibenzofuran-4-amine
CID 174314025
N-[4-(4-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)naphtho[1,2-b][1]benzofuran-10-amine
CID 177121496
7-tert-butyl-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-(8-methylnaphthalen-1-yl)fluoren-2-amine
CID 174309727
N-(2-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-3-amine
CID 167177941
2',7'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-1-amine
CID 142508986
2',7'-ditert-butyl-N-(9,9-dimethylfluoren-4-yl)-N-(3-methylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 156556780
4-tert-butyl-N-(7-tert-butyl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)dibenzofuran-2-amine
CID 174312572

Frequently Asked Questions

What is the IUPAC name of 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine?
The IUPAC name of 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine (CID 174315756) is 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine.
What is the SMILES notation for 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine?
The canonical SMILES for 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine is Cc1ccc(-c2cccc3c2oc2c(C)cc(C)cc23)c(N(C2=CC3=C(c4ccccc4C3(C)C)C(C)C2)c2ccc3c(c2)C(C)(C)c2cc(C(C)(C)C)ccc2-3)c1.
What is the InChIKey of 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine?
The InChIKey is YEUBTAAGWMTBKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H55NO/c1-32-19-22-41(42-16-14-17-43-45-26-33(2)25-35(4)52(45)58-53(42)43)50(27-32)57(38-28-34(3)51-44-15-12-13-18-46(44)55(8,9)49(51)31-38)37-21-24-40-39-23-20-36(54(5,6)7)29-47(39)56(10,11)48(40)30-37/h12-27,29-31,34H,28H2,1-11H3.
What are the key properties of 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine?
7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine has a molecular weight of 758.06 g/mol, XLogP of 15.59, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-tert-butyl-N-[2-(6,8-dimethyldibenzofuran-4-yl)-5-methylphenyl]-9,9-dimethyl-N-(4,9,9-trimethyl-3,4-dihydrofluoren-2-yl)fluoren-2-amine is sourced from PubChem (CID 174315756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).