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

C126H90N2O2 — CID 157073472

IUPAC7-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
SMILESCC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc21.CC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5ccccc5)c4)cc3)cc21
InChIInChI=1S/2C63H45NO/c1-63(2)59-40-51(50-28-36-62-58(39-50)57-21-9-10-22-61(57)65-62)27-34-55(59)56-35-33-54(41-60(56)63)64(52-29-23-44(24-30-52)48-19-11-17-46(37-48)42-13-5-3-6-14-42)53-31-25-45(26-32-53)49-20-12-18-47(38-49)43-15-7-4-8-16-43;1-63(2)59-40-51(50-30-38-62-58(39-50)57-15-9-10-16-61(57)65-62)29-36-55(59)56-37-35-54(41-60(56)63)64(52-31-25-48(26-32-52)46-21-17-44(18-22-46)42-11-5-3-6-12-42)53-33-27-49(28-34-53)47-23-19-45(20-24-47)43-13-7-4-8-14-43/h2*3-41H,1-2H3
InChIKeyACRUOKQCRYOGQD-UHFFFAOYSA-N
MW1664.12 g/mol
LogP35.39
Rot. Bonds16

About 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

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 (PubChem CID 157073472) has the molecular formula C126H90N2O2 and a molecular weight of 1664.12 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name7-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
PubChem CID157073472
Molecular FormulaC126H90N2O2
Molecular Weight1664.12 g/mol
Exact Mass1662.70
IUPAC Name7-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
SMILESCC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc21.CC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5ccccc5)c4)cc3)cc21
InChIInChI=1S/2C63H45NO/c1-63(2)59-40-51(50-28-36-62-58(39-50)57-21-9-10-22-61(57)65-62)27-34-55(59)56-35-33-54(41-60(56)63)64(52-29-23-44(24-30-52)48-19-11-17-46(37-48)42-13-5-3-6-14-42)53-31-25-45(26-32-53)49-20-12-18-47(38-49)43-15-7-4-8-16-43;1-63(2)59-40-51(50-30-38-62-58(39-50)57-15-9-10-16-61(57)65-62)29-36-55(59)56-37-35-54(41-60(56)63)64(52-31-25-48(26-32-52)46-21-17-44(18-22-46)42-11-5-3-6-12-42)53-33-27-49(28-34-53)47-23-19-45(20-24-47)43-13-7-4-8-14-43/h2*3-41H,1-2H3
InChIKeyACRUOKQCRYOGQD-UHFFFAOYSA-N
XLogP35.39
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms130
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001664.12
LogP ≤ 535.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc21.CC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5ccccc5)c4)cc3)cc21.
What is the InChIKey of 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?
The InChIKey is ACRUOKQCRYOGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C63H45NO/c1-63(2)59-40-51(50-28-36-62-58(39-50)57-21-9-10-22-61(57)65-62)27-34-55(59)56-35-33-54(41-60(56)63)64(52-29-23-44(24-30-52)48-19-11-17-46(37-48)42-13-5-3-6-14-42)53-31-25-45(26-32-53)49-20-12-18-47(38-49)43-15-7-4-8-16-43;1-63(2)59-40-51(50-30-38-62-58(39-50)57-15-9-10-16-61(57)65-62)29-36-55(59)56-37-35-54(41-60(56)63)64(52-31-25-48(26-32-52)46-21-17-44(18-22-46)42-11-5-3-6-12-42)53-33-27-49(28-34-53)47-23-19-45(20-24-47)43-13-7-4-8-14-43/h2*3-41H,1-2H3.
What are the key properties of 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?
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 has a molecular weight of 1664.12 g/mol, XLogP of 35.39, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 157073472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).