N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine

C61H37NO2 — CID 130463123

About N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine

N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine (PubChem CID 130463123) has the molecular formula C61H37NO2 and a molecular weight of 815.97 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine.

Molecular Properties

• Compound Name: N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine
• PubChem CID: 130463123
• Molecular Formula: C61H37NO2
• Molecular Weight: 815.97 g/mol
• Exact Mass: 815.28
• IUPAC Name: N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine
• SMILES: c1ccc(-c2ccccc2N(c2ccc3c(c2)-c2ccccc2-c2ccccc2C32c3ccccc3-c3cc4oc5ccccc5c4cc32)c2ccc3c(c2)oc2ccccc23)cc1
• InChI: InChI=1S/C61H37NO2/c1-2-16-38(17-3-1)41-18-8-13-27-56(41)62(40-30-32-48-46-23-9-14-28-57(46)63-59(48)35-40)39-31-33-54-49(34-39)43-20-5-4-19-42(43)44-21-6-11-25-52(44)61(54)53-26-12-7-22-45(53)50-37-60-51(36-55(50)61)47-24-10-15-29-58(47)64-60/h1-37H
• InChIKey: PVOVXKSFYINTAX-UHFFFAOYSA-N
• XLogP: 16.63
• TPSA: 29.52 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 64
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	815.97
LogP ≤ 5	16.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine?

The IUPAC name of N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine (CID 130463123) is N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine.

What is the SMILES notation for N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine?

The canonical SMILES for N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine is c1ccc(-c2ccccc2N(c2ccc3c(c2)-c2ccccc2-c2ccccc2C32c3ccccc3-c3cc4oc5ccccc5c4cc32)c2ccc3c(c2)oc2ccccc23)cc1.

What is the InChIKey of N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine?

The InChIKey is PVOVXKSFYINTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H37NO2/c1-2-16-38(17-3-1)41-18-8-13-27-56(41)62(40-30-32-48-46-23-9-14-28-57(46)63-59(48)35-40)39-31-33-54-49(34-39)43-20-5-4-19-42(43)44-21-6-11-25-52(44)61(54)53-26-12-7-22-45(53)50-37-60-51(36-55(50)61)47-24-10-15-29-58(47)64-60/h1-37H.

What are the key properties of N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine?

N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine has a molecular weight of 815.97 g/mol, XLogP of 16.63, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-dibenzofuran-3-yl-N-(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine is sourced from PubChem (CID 130463123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).