N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine

C164H130N6O3 — CID 161459182

IUPACN-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc2c(c1)Oc1ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3cccc4ccccc34)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)Oc1ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3cccc4ccccc34)cc1C21C2CC3CC(C2)CC1C3
InChIInChI=1S/C58H46N2O.C56H44N2O.C50H40N2O/c1-2-11-40(12-3-1)41-21-25-46(26-22-41)59(49-29-30-57-53(37-49)58(52-17-6-9-20-56(52)61-57)44-32-38-31-39(34-44)35-45(58)33-38)47-27-23-42(24-28-47)43-13-10-14-48(36-43)60-54-18-7-4-15-50(54)51-16-5-8-19-55(51)60;1-2-12-46-40(10-1)11-9-18-51(46)57(45-28-29-55-50(35-45)56(49-15-5-8-19-54(49)59-55)41-31-36-30-37(33-41)34-42(56)32-36)43-24-20-38(21-25-43)39-22-26-44(27-23-39)58-52-16-6-3-13-47(52)48-14-4-7-17-53(48)58;1-2-12-40-34(10-1)11-9-18-45(40)51(37-20-22-38(23-21-37)52-46-16-6-3-13-41(46)42-14-4-7-17-47(42)52)39-24-25-49-44(31-39)50(43-15-5-8-19-48(43)53-49)35-27-32-26-33(29-35)30-36(50)28-32/h1-30,36-39,44-45H,31-35H2;1-29,35-37,41-42H,30-34H2;1-25,31-33,35-36H,26-30H2
InChIKeyWBOMNZMDCZKWPK-UHFFFAOYSA-N
MW2232.88 g/mol
LogP43.61
Rot. Bonds15

About N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine

N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine (PubChem CID 161459182) has the molecular formula C164H130N6O3 and a molecular weight of 2232.88 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine
PubChem CID161459182
Molecular FormulaC164H130N6O3
Molecular Weight2232.88 g/mol
Exact Mass2231.02
IUPAC NameN-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc2c(c1)Oc1ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3cccc4ccccc34)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)Oc1ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3cccc4ccccc34)cc1C21C2CC3CC(C2)CC1C3
InChIInChI=1S/C58H46N2O.C56H44N2O.C50H40N2O/c1-2-11-40(12-3-1)41-21-25-46(26-22-41)59(49-29-30-57-53(37-49)58(52-17-6-9-20-56(52)61-57)44-32-38-31-39(34-44)35-45(58)33-38)47-27-23-42(24-28-47)43-13-10-14-48(36-43)60-54-18-7-4-15-50(54)51-16-5-8-19-55(51)60;1-2-12-46-40(10-1)11-9-18-51(46)57(45-28-29-55-50(35-45)56(49-15-5-8-19-54(49)59-55)41-31-36-30-37(33-41)34-42(56)32-36)43-24-20-38(21-25-43)39-22-26-44(27-23-39)58-52-16-6-3-13-47(52)48-14-4-7-17-53(48)58;1-2-12-40-34(10-1)11-9-18-45(40)51(37-20-22-38(23-21-37)52-46-16-6-3-13-41(46)42-14-4-7-17-47(42)52)39-24-25-49-44(31-39)50(43-15-5-8-19-48(43)53-49)35-27-32-26-33(29-35)30-36(50)28-32/h1-30,36-39,44-45H,31-35H2;1-29,35-37,41-42H,30-34H2;1-25,31-33,35-36H,26-30H2
InChIKeyWBOMNZMDCZKWPK-UHFFFAOYSA-N
XLogP43.61
TPSA52.20 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds15
Heavy Atoms173
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002232.88
LogP ≤ 543.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine (CID 161459182) is N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine is c1ccc(-c2ccc(N(c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc3)c3ccc4c(c3)C3(c5ccccc5O4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc2c(c1)Oc1ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3cccc4ccccc34)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)Oc1ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3cccc4ccccc34)cc1C21C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine?
The InChIKey is WBOMNZMDCZKWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H46N2O.C56H44N2O.C50H40N2O/c1-2-11-40(12-3-1)41-21-25-46(26-22-41)59(49-29-30-57-53(37-49)58(52-17-6-9-20-56(52)61-57)44-32-38-31-39(34-44)35-45(58)33-38)47-27-23-42(24-28-47)43-13-10-14-48(36-43)60-54-18-7-4-15-50(54)51-16-5-8-19-55(51)60;1-2-12-46-40(10-1)11-9-18-51(46)57(45-28-29-55-50(35-45)56(49-15-5-8-19-54(49)59-55)41-31-36-30-37(33-41)34-42(56)32-36)43-24-20-38(21-25-43)39-22-26-44(27-23-39)58-52-16-6-3-13-47(52)48-14-4-7-17-53(48)58;1-2-12-40-34(10-1)11-9-18-45(40)51(37-20-22-38(23-21-37)52-46-16-6-3-13-41(46)42-14-4-7-17-47(42)52)39-24-25-49-44(31-39)50(43-15-5-8-19-48(43)53-49)35-27-32-26-33(29-35)30-36(50)28-32/h1-30,36-39,44-45H,31-35H2;1-29,35-37,41-42H,30-34H2;1-25,31-33,35-36H,26-30H2.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine?
N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine has a molecular weight of 2232.88 g/mol, XLogP of 43.61, 15 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylspiro[adamantane-2,9'-xanthene]-2'-amine;N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)spiro[adamantane-2,9'-xanthene]-2'-amine is sourced from PubChem (CID 161459182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).