N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine

C202H170N4O4 — CID 158937310

IUPACN,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4-c4cccc5oc6ccccc6c45)cc3)c3cccc4c3-c3ccccc3C43C4CC5CC(C4)CC3C5)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc21.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C4(c6ccccc6O5)C5CC6CC(C5)CC4C6)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc2)cc1
InChIInChI=1S/C61H49NO.C52H43NO.C46H39NO.C43H39NO/c1-60(2)51-19-8-5-15-46(51)47-30-29-43(36-54(47)60)62(55-22-12-21-53-59(55)49-16-6-9-20-52(49)61(53)40-32-37-31-38(34-40)35-41(61)33-37)42-27-25-39(26-28-42)44-13-3-4-14-45(44)48-18-11-24-57-58(48)50-17-7-10-23-56(50)63-57;1-3-9-37(10-4-1)39-15-17-40(18-16-39)42-21-25-46(26-22-42)53(45-23-19-41(20-24-45)38-11-5-2-6-12-38)47-27-28-51-49(34-47)52(48-13-7-8-14-50(48)54-51)43-30-35-29-36(32-43)33-44(52)31-35;1-3-9-33(10-4-1)35-15-19-39(20-16-35)47(40-21-17-36(18-22-40)34-11-5-2-6-12-34)41-23-24-45-43(30-41)46(42-13-7-8-14-44(42)48-45)37-26-31-25-32(28-37)29-38(46)27-31;1-42(2)36-13-7-6-12-34(36)35-18-16-32(25-38(35)42)44(31-10-4-3-5-11-31)33-17-19-41-39(26-33)43(37-14-8-9-15-40(37)45-41)29-21-27-20-28(23-29)24-30(43)22-27/h3-30,36-38,40-41H,31-35H2,1-2H3;1-28,34-36,43-44H,29-33H2;1-24,30-32,37-38H,25-29H2;3-19,25-30H,20-24H2,1-2H3
InChIKeyJJUSIOZLHPKGAE-UHFFFAOYSA-N
MW2717.61 g/mol
LogP54.07
Rot. Bonds19

About N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine

N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine (PubChem CID 158937310) has the molecular formula C202H170N4O4 and a molecular weight of 2717.61 g/mol. Its IUPAC name is N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine.

Molecular Properties

Compound NameN,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine
PubChem CID158937310
Molecular FormulaC202H170N4O4
Molecular Weight2717.61 g/mol
Exact Mass2715.32
IUPAC NameN,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4-c4cccc5oc6ccccc6c45)cc3)c3cccc4c3-c3ccccc3C43C4CC5CC(C4)CC3C5)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc21.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C4(c6ccccc6O5)C5CC6CC(C5)CC4C6)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc2)cc1
InChIInChI=1S/C61H49NO.C52H43NO.C46H39NO.C43H39NO/c1-60(2)51-19-8-5-15-46(51)47-30-29-43(36-54(47)60)62(55-22-12-21-53-59(55)49-16-6-9-20-52(49)61(53)40-32-37-31-38(34-40)35-41(61)33-37)42-27-25-39(26-28-42)44-13-3-4-14-45(44)48-18-11-24-57-58(48)50-17-7-10-23-56(50)63-57;1-3-9-37(10-4-1)39-15-17-40(18-16-39)42-21-25-46(26-22-42)53(45-23-19-41(20-24-45)38-11-5-2-6-12-38)47-27-28-51-49(34-47)52(48-13-7-8-14-50(48)54-51)43-30-35-29-36(32-43)33-44(52)31-35;1-3-9-33(10-4-1)35-15-19-39(20-16-35)47(40-21-17-36(18-22-40)34-11-5-2-6-12-34)41-23-24-45-43(30-41)46(42-13-7-8-14-44(42)48-45)37-26-31-25-32(28-37)29-38(46)27-31;1-42(2)36-13-7-6-12-34(36)35-18-16-32(25-38(35)42)44(31-10-4-3-5-11-31)33-17-19-41-39(26-33)43(37-14-8-9-15-40(37)45-41)29-21-27-20-28(23-29)24-30(43)22-27/h3-30,36-38,40-41H,31-35H2,1-2H3;1-28,34-36,43-44H,29-33H2;1-24,30-32,37-38H,25-29H2;3-19,25-30H,20-24H2,1-2H3
InChIKeyJJUSIOZLHPKGAE-UHFFFAOYSA-N
XLogP54.07
TPSA53.79 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds19
Heavy Atoms210
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002717.61
LogP ≤ 554.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine with MolForge

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Related Compounds

N-(2-dibenzofuran-1-ylphenyl)-N-[4-(9,9-dimethylfluoren-1-yl)phenyl]spiro[adamantane-2,9'-fluorene]-2'-amine
CID 170215998
N-(9,9-dimethylfluoren-2-yl)-N-(4-spiro[adamantane-2,9'-fluorene]-4'-ylphenyl)dibenzofuran-3-amine;N,4-diphenyl-N-(4-spiro[adamantane-2,9'-fluorene]-4'-ylphenyl)aniline;N-(2-phenylphenyl)-N-(4-spiro[adamantane-2,9'-fluorene]-4'-ylphenyl)dibenzothiophen-3-amine
CID 159942017
N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine
CID 162212897
N-(9,9-dimethylfluoren-2-yl)-N-spiro[fluorene-9,2'-tricyclo[4.3.1.13,8]undecane]-4-yldibenzofuran-3-amine
CID 167056502
N-(3-dibenzofuran-1-ylphenyl)-N-[2-(9,9-dimethylfluoren-1-yl)phenyl]spiro[adamantane-2,9'-fluorene]-2'-amine
CID 170217258
9,9-dimethyl-N-(3-methyl-4-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)-N-(4-phenylphenyl)fluoren-4-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-phenyl-4-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-4-amine;N-(3-methyl-4-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 159494511
N-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-[4-[2-[1-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]dibenzofuran-2-yl]dibenzofuran-1-yl]phenyl]fluoren-2-amine
CID 138481428
6-N-(9,9-dimethylfluoren-2-yl)-1-N,6-N-diphenyl-1-N-spiro[adamantane-2,9'-fluorene]-4'-ylpyrene-1,6-diamine
CID 156533302
N-[2-dibenzofuran-1-yl-3-(4-phenylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 167285876
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 155393837
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine
CID 160744068
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-[1-(2-phenylphenyl)dibenzofuran-2-yl]phenyl]fluoren-2-amine
CID 177281131

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine?
The IUPAC name of N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine (CID 158937310) is N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine.
What is the SMILES notation for N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine?
The canonical SMILES for N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4-c4cccc5oc6ccccc6c45)cc3)c3cccc4c3-c3ccccc3C43C4CC5CC(C4)CC3C5)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc21.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C4(c6ccccc6O5)C5CC6CC(C5)CC4C6)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc2)cc1.
What is the InChIKey of N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine?
The InChIKey is JJUSIOZLHPKGAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H49NO.C52H43NO.C46H39NO.C43H39NO/c1-60(2)51-19-8-5-15-46(51)47-30-29-43(36-54(47)60)62(55-22-12-21-53-59(55)49-16-6-9-20-52(49)61(53)40-32-37-31-38(34-40)35-41(61)33-37)42-27-25-39(26-28-42)44-13-3-4-14-45(44)48-18-11-24-57-58(48)50-17-7-10-23-56(50)63-57;1-3-9-37(10-4-1)39-15-17-40(18-16-39)42-21-25-46(26-22-42)53(45-23-19-41(20-24-45)38-11-5-2-6-12-38)47-27-28-51-49(34-47)52(48-13-7-8-14-50(48)54-51)43-30-35-29-36(32-43)33-44(52)31-35;1-3-9-33(10-4-1)35-15-19-39(20-16-35)47(40-21-17-36(18-22-40)34-11-5-2-6-12-34)41-23-24-45-43(30-41)46(42-13-7-8-14-44(42)48-45)37-26-31-25-32(28-37)29-38(46)27-31;1-42(2)36-13-7-6-12-34(36)35-18-16-32(25-38(35)42)44(31-10-4-3-5-11-31)33-17-19-41-39(26-33)43(37-14-8-9-15-40(37)45-41)29-21-27-20-28(23-29)24-30(43)22-27/h3-30,36-38,40-41H,31-35H2,1-2H3;1-28,34-36,43-44H,29-33H2;1-24,30-32,37-38H,25-29H2;3-19,25-30H,20-24H2,1-2H3.
What are the key properties of N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine?
N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine has a molecular weight of 2717.61 g/mol, XLogP of 54.07, 19 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(2-dibenzofuran-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)spiro[adamantane-2,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[adamantane-2,9'-xanthene]-2'-amine;N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[adamantane-2,9'-xanthene]-2'-amine is sourced from PubChem (CID 158937310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).