N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine

C183H121N3 — CID 167535824

About N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine

N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine (PubChem CID 167535824) has the molecular formula C183H121N3 and a molecular weight of 2362.00 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine.

Molecular Properties

• Compound Name: N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine
• PubChem CID: 167535824
• Molecular Formula: C183H121N3
• Molecular Weight: 2362.00 g/mol
• Exact Mass: 2359.96
• IUPAC Name: N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine
• SMILES: CC1(C)c2ccccc2-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)C3(c5cc6ccccc6cc5-4)c4ccc5ccccc5c4-c4c3ccc3ccccc43)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-c5ccc6ccccc6c53)c3ccc5ccccc5c3-4)c3ccc4ccccc4c3)cc21.c1ccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2cc3c(c4ccccc24)-c2c(ccc4ccccc24)C32c3ccccc3-c3ccccc32)cc1
• InChI: InChI=1S/C70H47N.C58H39N.C55H35N/c1-69(2)61-28-16-15-27-57(61)58-33-31-52(42-64(58)69)71(54-38-50(44-17-5-3-6-18-44)37-51(39-54)45-19-7-4-8-20-45)53-32-34-59-60-40-48-23-9-10-24-49(48)41-65(60)70(66(59)43-53)62-35-29-46-21-11-13-25-55(46)67(62)68-56-26-14-12-22-47(56)30-36-63(68)70;1-57(2)50-21-11-9-19-45(50)47-30-27-41(34-53(47)57)59(40-26-23-36-13-3-4-16-39(36)33-40)42-28-31-49-54(35-42)58(52-32-25-37-14-5-7-17-43(37)55(49)52)51-22-12-10-20-46(51)48-29-24-38-15-6-8-18-44(38)56(48)58;1-2-18-39(19-3-1)56(40-32-29-38(30-33-40)42-26-14-17-36-15-4-6-20-41(36)42)52-35-51-54(47-25-9-8-24-46(47)52)53-43-21-7-5-16-37(43)31-34-50(53)55(51)48-27-12-10-22-44(48)45-23-11-13-28-49(45)55/h3-43H,1-2H3;3-35H,1-2H3;1-35H
• InChIKey: ANXSDQPJSSFWOS-UHFFFAOYSA-N
• XLogP: 48.49
• TPSA: 9.72 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 12
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2362.00
LogP ≤ 5	48.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine?

The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine (CID 167535824) is N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine.

What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine?

The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine is CC1(C)c2ccccc2-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)C3(c5cc6ccccc6cc5-4)c4ccc5ccccc5c4-c4c3ccc3ccccc43)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-c5ccc6ccccc6c53)c3ccc5ccccc5c3-4)c3ccc4ccccc4c3)cc21.c1ccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2cc3c(c4ccccc24)-c2c(ccc4ccccc24)C32c3ccccc3-c3ccccc32)cc1.

What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine?

The InChIKey is ANXSDQPJSSFWOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H47N.C58H39N.C55H35N/c1-69(2)61-28-16-15-27-57(61)58-33-31-52(42-64(58)69)71(54-38-50(44-17-5-3-6-18-44)37-51(39-54)45-19-7-4-8-20-45)53-32-34-59-60-40-48-23-9-10-24-49(48)41-65(60)70(66(59)43-53)62-35-29-46-21-11-13-25-55(46)67(62)68-56-26-14-12-22-47(56)30-36-63(68)70;1-57(2)50-21-11-9-19-45(50)47-30-27-41(34-53(47)57)59(40-26-23-36-13-3-4-16-39(36)33-40)42-28-31-49-54(35-42)58(52-32-25-37-14-5-7-17-43(37)55(49)52)51-22-12-10-20-46(51)48-29-24-38-15-6-8-18-44(38)56(48)58;1-2-18-39(19-3-1)56(40-32-29-38(30-33-40)42-26-14-17-36-15-4-6-20-41(36)42)52-35-51-54(47-25-9-8-24-46(47)52)53-43-21-7-5-16-37(43)31-34-50(53)55(51)48-27-12-10-22-44(48)45-23-11-13-28-49(45)55/h3-43H,1-2H3;3-35H,1-2H3;1-35H.

What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine?

N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine has a molecular weight of 2362.00 g/mol, XLogP of 48.49, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-dimethylfluoren-2-yl)-N-(3,5-diphenylphenyl)spiro[benzo[b]fluorene-11,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-ylspiro[benzo[a]fluorene-11,7'-benzo[g]fluorene]-9'-amine;N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9'-amine is sourced from PubChem (CID 167535824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).