N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine

C202H134N8O — CID 164960100

IUPACN-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cccc5cccc-4c35)c3ccccc3-c3ccccc3)cc21.[C-]#[N+]c1ccc(N(c2ccccc2)c2ccc3c4c(cccc24)C2(c4ccccc4-c4ccc(N(c5ccccc5)c5ccc(C#N)cc5)cc42)c2ccccc2-3)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3-c3cccc4cccc2c34)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C56H39N.C55H34N4.C47H29NO.C44H32N2/c1-55(2)47-25-10-6-21-41(47)44-32-30-38(34-51(44)55)57(53-29-13-9-20-40(53)36-16-4-3-5-17-36)39-31-33-45-46-24-14-18-37-19-15-28-50(54(37)46)56(52(45)35-39)48-26-11-7-22-42(48)43-23-8-12-27-49(43)56;1-57-38-25-29-42(30-26-38)59(40-15-6-3-7-16-40)53-34-33-47-45-18-9-11-21-50(45)55(51-22-12-19-48(53)54(47)51)49-20-10-8-17-44(49)46-32-31-43(35-52(46)55)58(39-13-4-2-5-14-39)41-27-23-37(36-56)24-28-41;1-2-15-31(16-3-1)48(43-25-12-21-38-36-19-6-9-26-44(36)49-46(38)43)32-27-28-35-33-17-4-7-22-39(33)47(42(35)29-32)40-23-8-5-18-34(40)37-20-10-13-30-14-11-24-41(47)45(30)37;1-3-17-37(18-4-1)45(43-23-11-15-35-13-7-9-21-41(35)43)39-29-25-33(26-30-39)34-27-31-40(32-28-34)46(38-19-5-2-6-20-38)44-24-12-16-36-14-8-10-22-42(36)44/h3-35H,1-2H3;2-35H;1-29H;1-32H
InChIKeyBSJFMPOAOAKMJO-UHFFFAOYSA-N
MW2689.35 g/mol
LogP54.32
Rot. Bonds20

About N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine

N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine (PubChem CID 164960100) has the molecular formula C202H134N8O and a molecular weight of 2689.35 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine
PubChem CID164960100
Molecular FormulaC202H134N8O
Molecular Weight2689.35 g/mol
Exact Mass2687.07
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cccc5cccc-4c35)c3ccccc3-c3ccccc3)cc21.[C-]#[N+]c1ccc(N(c2ccccc2)c2ccc3c4c(cccc24)C2(c4ccccc4-c4ccc(N(c5ccccc5)c5ccc(C#N)cc5)cc42)c2ccccc2-3)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3-c3cccc4cccc2c34)c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C56H39N.C55H34N4.C47H29NO.C44H32N2/c1-55(2)47-25-10-6-21-41(47)44-32-30-38(34-51(44)55)57(53-29-13-9-20-40(53)36-16-4-3-5-17-36)39-31-33-45-46-24-14-18-37-19-15-28-50(54(37)46)56(52(45)35-39)48-26-11-7-22-42(48)43-23-8-12-27-49(43)56;1-57-38-25-29-42(30-26-38)59(40-15-6-3-7-16-40)53-34-33-47-45-18-9-11-21-50(45)55(51-22-12-19-48(53)54(47)51)49-20-10-8-17-44(49)46-32-31-43(35-52(46)55)58(39-13-4-2-5-14-39)41-27-23-37(36-56)24-28-41;1-2-15-31(16-3-1)48(43-25-12-21-38-36-19-6-9-26-44(36)49-46(38)43)32-27-28-35-33-17-4-7-22-39(33)47(42(35)29-32)40-23-8-5-18-34(40)37-20-10-13-30-14-11-24-41(47)45(30)37;1-3-17-37(18-4-1)45(43-23-11-15-35-13-7-9-21-41(35)43)39-29-25-33(26-30-39)34-27-31-40(32-28-34)46(38-19-5-2-6-20-38)44-24-12-16-36-14-8-10-22-42(36)44/h3-35H,1-2H3;2-35H;1-29H;1-32H
InChIKeyBSJFMPOAOAKMJO-UHFFFAOYSA-N
XLogP54.32
TPSA60.73 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds20
Heavy Atoms211
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002689.35
LogP ≤ 554.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine (CID 164960100) is N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cccc5cccc-4c35)c3ccccc3-c3ccccc3)cc21.[C-]#[N+]c1ccc(N(c2ccccc2)c2ccc3c4c(cccc24)C2(c4ccccc4-c4ccc(N(c5ccccc5)c5ccc(C#N)cc5)cc42)c2ccccc2-3)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3-c3cccc4cccc2c34)c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine?
The InChIKey is BSJFMPOAOAKMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H39N.C55H34N4.C47H29NO.C44H32N2/c1-55(2)47-25-10-6-21-41(47)44-32-30-38(34-51(44)55)57(53-29-13-9-20-40(53)36-16-4-3-5-17-36)39-31-33-45-46-24-14-18-37-19-15-28-50(54(37)46)56(52(45)35-39)48-26-11-7-22-42(48)43-23-8-12-27-49(43)56;1-57-38-25-29-42(30-26-38)59(40-15-6-3-7-16-40)53-34-33-47-45-18-9-11-21-50(45)55(51-22-12-19-48(53)54(47)51)49-20-10-8-17-44(49)46-32-31-43(35-52(46)55)58(39-13-4-2-5-14-39)41-27-23-37(36-56)24-28-41;1-2-15-31(16-3-1)48(43-25-12-21-38-36-19-6-9-26-44(36)49-46(38)43)32-27-28-35-33-17-4-7-22-39(33)47(42(35)29-32)40-23-8-5-18-34(40)37-20-10-13-30-14-11-24-41(47)45(30)37;1-3-17-37(18-4-1)45(43-23-11-15-35-13-7-9-21-41(35)43)39-29-25-33(26-30-39)34-27-31-40(32-28-34)46(38-19-5-2-6-20-38)44-24-12-16-36-14-8-10-22-42(36)44/h3-35H,1-2H3;2-35H;1-29H;1-32H.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine?
N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine has a molecular weight of 2689.35 g/mol, XLogP of 54.32, 20 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)spiro[benzo[a]phenalene-7,9'-fluorene]-9-amine;4-(N-[3-(N-(4-isocyanophenyl)anilino)spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yl]anilino)benzonitrile;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-2'-yldibenzofuran-4-amine is sourced from PubChem (CID 164960100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).