N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine

C143H103N3O3 — CID 161220626

IUPACN-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine
SMILESCC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc5ccccc5c4)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4cccc5ccccc45)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)ccc21
InChIInChI=1S/2C49H35NO.C45H33NO/c1-49(2)44-15-7-5-13-40(44)42-30-35(22-28-45(42)49)32-18-24-37(25-19-32)50(46-16-9-11-34-10-3-4-12-39(34)46)38-26-20-33(21-27-38)36-23-29-48-43(31-36)41-14-6-8-17-47(41)51-48;1-49(2)45-13-7-5-11-41(45)43-30-36(20-27-46(43)49)33-15-22-38(23-16-33)50(40-26-19-32-9-3-4-10-35(32)29-40)39-24-17-34(18-25-39)37-21-28-48-44(31-37)42-12-6-8-14-47(42)51-48;1-45(2)41-14-8-6-12-37(41)39-28-32(20-26-42(39)45)30-16-22-35(23-17-30)46(34-10-4-3-5-11-34)36-24-18-31(19-25-36)33-21-27-44-40(29-33)38-13-7-9-15-43(38)47-44/h2*3-31H,1-2H3;3-29H,1-2H3
InChIKeyUXLLHFMIKIOSLN-UHFFFAOYSA-N
MW1911.41 g/mol
LogP40.39
Rot. Bonds15

About N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine

N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine (PubChem CID 161220626) has the molecular formula C143H103N3O3 and a molecular weight of 1911.41 g/mol. Its IUPAC name is N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine
PubChem CID161220626
Molecular FormulaC143H103N3O3
Molecular Weight1911.41 g/mol
Exact Mass1909.80
IUPAC NameN-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine
SMILESCC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc5ccccc5c4)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4cccc5ccccc45)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)ccc21
InChIInChI=1S/2C49H35NO.C45H33NO/c1-49(2)44-15-7-5-13-40(44)42-30-35(22-28-45(42)49)32-18-24-37(25-19-32)50(46-16-9-11-34-10-3-4-12-39(34)46)38-26-20-33(21-27-38)36-23-29-48-43(31-36)41-14-6-8-17-47(41)51-48;1-49(2)45-13-7-5-11-41(45)43-30-36(20-27-46(43)49)33-15-22-38(23-16-33)50(40-26-19-32-9-3-4-10-35(32)29-40)39-24-17-34(18-25-39)37-21-28-48-44(31-37)42-12-6-8-14-47(42)51-48;1-45(2)41-14-8-6-12-37(41)39-28-32(20-26-42(39)45)30-16-22-35(23-17-30)46(34-10-4-3-5-11-34)36-24-18-31(19-25-36)33-21-27-44-40(29-33)38-13-7-9-15-43(38)47-44/h2*3-31H,1-2H3;3-29H,1-2H3
InChIKeyUXLLHFMIKIOSLN-UHFFFAOYSA-N
XLogP40.39
TPSA49.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms149
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001911.41
LogP ≤ 540.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine?
The IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine (CID 161220626) is N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine.
What is the SMILES notation for N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine?
The canonical SMILES for N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine is CC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc5ccccc5c4)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4cccc5ccccc45)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)ccc21.
What is the InChIKey of N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine?
The InChIKey is UXLLHFMIKIOSLN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C49H35NO.C45H33NO/c1-49(2)44-15-7-5-13-40(44)42-30-35(22-28-45(42)49)32-18-24-37(25-19-32)50(46-16-9-11-34-10-3-4-12-39(34)46)38-26-20-33(21-27-38)36-23-29-48-43(31-36)41-14-6-8-17-47(41)51-48;1-49(2)45-13-7-5-11-41(45)43-30-36(20-27-46(43)49)33-15-22-38(23-16-33)50(40-26-19-32-9-3-4-10-35(32)29-40)39-24-17-34(18-25-39)37-21-28-48-44(31-37)42-12-6-8-14-47(42)51-48;1-45(2)41-14-8-6-12-37(41)39-28-32(20-26-42(39)45)30-16-22-35(23-17-30)46(34-10-4-3-5-11-34)36-24-18-31(19-25-36)33-21-27-44-40(29-33)38-13-7-9-15-43(38)47-44/h2*3-31H,1-2H3;3-29H,1-2H3.
What are the key properties of N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine?
N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine has a molecular weight of 1911.41 g/mol, XLogP of 40.39, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine is sourced from PubChem (CID 161220626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).