N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine

C182H148N4OS2 — CID 161073329

About N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine

N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine (PubChem CID 161073329) has the molecular formula C182H148N4OS2 and a molecular weight of 2471.35 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine.

Molecular Properties

• Compound Name: N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine
• PubChem CID: 161073329
• Molecular Formula: C182H148N4OS2
• Molecular Weight: 2471.35 g/mol
• Exact Mass: 2469.11
• IUPAC Name: N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine
• SMILES: c1ccc(-c2ccc(N(c3ccc4c(c3)sc3ccccc34)c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4sc5ccccc5c4c3)c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc(-c2ccc(N(c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)c3cccc4ccccc34)cc2)cc1
• InChI: InChI=1S/C46H37NO.2C46H37NS.C44H37N/c1-2-9-31(10-3-1)32-17-19-35(20-18-32)47(36-21-22-44-40(28-36)38-12-5-7-16-43(38)48-44)42-15-8-13-39-37-11-4-6-14-41(37)46(45(39)42)33-24-29-23-30(26-33)27-34(46)25-29;1-2-9-31(10-3-1)32-17-19-35(20-18-32)47(36-21-22-39-38-12-5-7-16-43(38)48-44(39)28-36)42-15-8-13-40-37-11-4-6-14-41(37)46(45(40)42)33-24-29-23-30(26-33)27-34(46)25-29;1-2-9-31(10-3-1)32-17-19-35(20-18-32)47(36-21-22-44-40(28-36)38-12-5-7-16-43(38)48-44)42-15-8-13-39-37-11-4-6-14-41(37)46(45(39)42)33-24-29-23-30(26-33)27-34(46)25-29;1-2-10-31(11-3-1)32-20-22-36(23-21-32)45(41-18-8-13-33-12-4-5-14-37(33)41)42-19-9-16-39-38-15-6-7-17-40(38)44(43(39)42)34-25-29-24-30(27-34)28-35(44)26-29/h3*1-22,28-30,33-34H,23-27H2;1-23,29-30,34-35H,24-28H2
• InChIKey: UEYCZEYYLSHSPM-UHFFFAOYSA-N
• XLogP: 49.97
• TPSA: 26.10 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 16
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2471.35
LogP ≤ 5	49.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine?

The IUPAC name of N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine (CID 161073329) is N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine.

What is the SMILES notation for N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine?

The canonical SMILES for N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)sc3ccccc34)c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4sc5ccccc5c4c3)c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)cc2)cc1.c1ccc(-c2ccc(N(c3cccc4c3C3(c5ccccc5-4)C4CC5CC(C4)CC3C5)c3cccc4ccccc34)cc2)cc1.

What is the InChIKey of N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine?

The InChIKey is UEYCZEYYLSHSPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H37NO.2C46H37NS.C44H37N/c1-2-9-31(10-3-1)32-17-19-35(20-18-32)47(36-21-22-44-40(28-36)38-12-5-7-16-43(38)48-44)42-15-8-13-39-37-11-4-6-14-41(37)46(45(39)42)33-24-29-23-30(26-33)27-34(46)25-29;1-2-9-31(10-3-1)32-17-19-35(20-18-32)47(36-21-22-39-38-12-5-7-16-43(38)48-44(39)28-36)42-15-8-13-40-37-11-4-6-14-41(37)46(45(40)42)33-24-29-23-30(26-33)27-34(46)25-29;1-2-9-31(10-3-1)32-17-19-35(20-18-32)47(36-21-22-44-40(28-36)38-12-5-7-16-43(38)48-44)42-15-8-13-39-37-11-4-6-14-41(37)46(45(39)42)33-24-29-23-30(26-33)27-34(46)25-29;1-2-10-31(11-3-1)32-20-22-36(23-21-32)45(41-18-8-13-33-12-4-5-14-37(33)41)42-19-9-16-39-38-15-6-7-17-40(38)44(43(39)42)34-25-29-24-30(27-34)28-35(44)26-29/h3*1-22,28-30,33-34H,23-27H2;1-23,29-30,34-35H,24-28H2.

What are the key properties of N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine?

N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine has a molecular weight of 2471.35 g/mol, XLogP of 49.97, 16 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-1'-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-2-amine;N-(4-phenylphenyl)-N-spiro[adamantane-2,9'-fluorene]-1'-yldibenzothiophen-3-amine is sourced from PubChem (CID 161073329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).