N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine

C74H48N2 — CID 135167267

About N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine

N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine (PubChem CID 135167267) has the molecular formula C74H48N2 and a molecular weight of 965.21 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine.

Molecular Properties

• Compound Name: N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine
• PubChem CID: 135167267
• Molecular Formula: C74H48N2
• Molecular Weight: 965.21 g/mol
• Exact Mass: 964.38
• IUPAC Name: N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine
• SMILES: c1ccc(-c2cccc(-c3ccccc3N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)c3cccc5c3n4-c3ccccc3C53c4ccccc4-c4ccccc43)c2)cc1
• InChI: InChI=1S/C74H48N2/c1-4-22-49(23-5-1)50-24-20-25-51(46-50)56-30-13-18-40-69(56)75(55-42-44-60-59-33-10-14-35-63(59)73(68(60)48-55,52-26-6-2-7-27-52)53-28-8-3-9-29-53)54-43-45-70-62(47-54)61-34-21-39-67-72(61)76(70)71-41-19-17-38-66(71)74(67)64-36-15-11-31-57(64)58-32-12-16-37-65(58)74/h1-48H
• InChIKey: XYUOYTFEOOLGGI-UHFFFAOYSA-N
• XLogP: 18.63
• TPSA: 8.17 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 7
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	965.21
LogP ≤ 5	18.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine?

The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine (CID 135167267) is N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine.

What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine?

The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine is c1ccc(-c2cccc(-c3ccccc3N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)c3cccc5c3n4-c3ccccc3C53c4ccccc4-c4ccccc43)c2)cc1.

What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine?

The InChIKey is XYUOYTFEOOLGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N2/c1-4-22-49(23-5-1)50-24-20-25-51(46-50)56-30-13-18-40-69(56)75(55-42-44-60-59-33-10-14-35-63(59)73(68(60)48-55,52-26-6-2-7-27-52)53-28-8-3-9-29-53)54-43-45-70-62(47-54)61-34-21-39-67-72(61)76(70)71-41-19-17-38-66(71)74(67)64-36-15-11-31-57(64)58-32-12-16-37-65(58)74/h1-48H.

What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine?

N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine has a molecular weight of 965.21 g/mol, XLogP of 18.63, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-5-amine is sourced from PubChem (CID 135167267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).