N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine

C101H67N3 — CID 160560775

About N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine

N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine (PubChem CID 160560775) has the molecular formula C101H67N3 and a molecular weight of 1322.67 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine.

Molecular Properties

• Compound Name: N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine
• PubChem CID: 160560775
• Molecular Formula: C101H67N3
• Molecular Weight: 1322.67 g/mol
• Exact Mass: 1321.53
• IUPAC Name: N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine
• SMILES: c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5-n5c6ccccc6c6cccc4c65)c4cccc5ccccc45)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4cccc5ccccc45)cc32)cc1
• InChI: InChI=1S/C66H42N2.C35H25N/c1-3-21-44(22-4-1)65(45-23-5-2-6-24-45)55-30-12-9-26-49(55)51-39-37-46(41-59(51)65)67(61-36-17-20-43-19-7-8-25-48(43)61)47-38-40-52-50-27-10-13-31-56(50)66(60(52)42-47)57-32-14-16-35-63(57)68-62-34-15-11-28-53(62)54-29-18-33-58(66)64(54)68;1-3-14-26(15-4-1)35(27-16-5-2-6-17-27)32-20-10-9-19-30(32)31-23-22-28(24-33(31)35)36-34-21-11-13-25-12-7-8-18-29(25)34/h1-42H;1-24,36H
• InChIKey: QZGVJKFAEMLATN-UHFFFAOYSA-N
• XLogP: 25.39
• TPSA: 20.20 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 9
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1322.67
LogP ≤ 5	25.39
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?

The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine (CID 160560775) is N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine.

What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?

The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5-n5c6ccccc6c6cccc4c65)c4cccc5ccccc45)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4cccc5ccccc45)cc32)cc1.

What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?

The InChIKey is QZGVJKFAEMLATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H42N2.C35H25N/c1-3-21-44(22-4-1)65(45-23-5-2-6-24-45)55-30-12-9-26-49(55)51-39-37-46(41-59(51)65)67(61-36-17-20-43-19-7-8-25-48(43)61)47-38-40-52-50-27-10-13-31-56(50)66(60(52)42-47)57-32-14-16-35-63(57)68-62-34-15-11-28-53(62)54-29-18-33-58(66)64(54)68;1-3-14-26(15-4-1)35(27-16-5-2-6-17-27)32-20-10-9-19-30(32)31-23-22-28(24-33(31)35)36-34-21-11-13-25-12-7-8-18-29(25)34/h1-42H;1-24,36H.

What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?

N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine has a molecular weight of 1322.67 g/mol, XLogP of 25.39, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-1-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine is sourced from PubChem (CID 160560775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).