N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine

C222H147N3 — CID 159615477

IUPACN-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
SMILESc1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5c(ccc6ccccc65)c3)c3ccc5c6ccccc6c6ccccc6c5c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1.c1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5c6ccccc6c6ccccc6c5c3)c3cc5ccccc5c5ccccc35)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1.c1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5ccc6ccccc6c5c3)c3ccc5c6ccccc6c6ccccc6c5c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1
InChIInChI=1S/3C74H49N/c1-2-18-51-46(17-1)31-32-47-41-49(34-37-52(47)51)75(50-35-38-57-55-21-4-3-19-53(55)54-20-5-6-22-56(54)64(57)43-50)72-45-71-65(44-63(72)48-33-36-62-58-23-7-11-27-66(58)73(70(62)42-48)39-15-16-40-73)61-26-10-14-30-69(61)74(71)67-28-12-8-24-59(67)60-25-9-13-29-68(60)74;1-2-18-51-46(17-1)31-32-47-33-35-49(42-62(47)51)75(50-36-38-56-54-21-4-3-19-52(54)53-20-5-6-22-55(53)64(56)43-50)72-45-71-65(44-63(72)48-34-37-61-57-23-7-11-27-66(57)73(70(61)41-48)39-15-16-40-73)60-26-10-14-30-69(60)74(71)67-28-12-8-24-58(67)59-25-9-13-29-68(59)74;1-2-20-49-46(19-1)42-71(61-30-8-7-21-50(49)61)75(48-36-38-55-53-24-4-3-22-51(53)52-23-5-6-25-54(52)63(55)43-48)72-45-70-64(44-62(72)47-35-37-60-56-26-9-13-31-65(56)73(69(60)41-47)39-17-18-40-73)59-29-12-16-34-68(59)74(70)66-32-14-10-27-57(66)58-28-11-15-33-67(58)74/h2*1-14,17-38,41-45H,15-16,39-40H2;1-16,19-38,41-45H,17-18,39-40H2
InChIKeyMNFPSCVDYOWRGV-UHFFFAOYSA-N
MW2856.64 g/mol
LogP59.32
Rot. Bonds12

About N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine

N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine (PubChem CID 159615477) has the molecular formula C222H147N3 and a molecular weight of 2856.64 g/mol. Its IUPAC name is N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine.

Molecular Properties

Compound NameN-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
PubChem CID159615477
Molecular FormulaC222H147N3
Molecular Weight2856.64 g/mol
Exact Mass2854.16
IUPAC NameN-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
SMILESc1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5c(ccc6ccccc65)c3)c3ccc5c6ccccc6c6ccccc6c5c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1.c1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5c6ccccc6c6ccccc6c5c3)c3cc5ccccc5c5ccccc35)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1.c1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5ccc6ccccc6c5c3)c3ccc5c6ccccc6c6ccccc6c5c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1
InChIInChI=1S/3C74H49N/c1-2-18-51-46(17-1)31-32-47-41-49(34-37-52(47)51)75(50-35-38-57-55-21-4-3-19-53(55)54-20-5-6-22-56(54)64(57)43-50)72-45-71-65(44-63(72)48-33-36-62-58-23-7-11-27-66(58)73(70(62)42-48)39-15-16-40-73)61-26-10-14-30-69(61)74(71)67-28-12-8-24-59(67)60-25-9-13-29-68(60)74;1-2-18-51-46(17-1)31-32-47-33-35-49(42-62(47)51)75(50-36-38-56-54-21-4-3-19-52(54)53-20-5-6-22-55(53)64(56)43-50)72-45-71-65(44-63(72)48-34-37-61-57-23-7-11-27-66(57)73(70(61)41-48)39-15-16-40-73)60-26-10-14-30-69(60)74(71)67-28-12-8-24-58(67)59-25-9-13-29-68(59)74;1-2-20-49-46(19-1)42-71(61-30-8-7-21-50(49)61)75(48-36-38-55-53-24-4-3-22-51(53)52-23-5-6-25-54(52)63(55)43-48)72-45-70-64(44-62(72)47-35-37-60-56-26-9-13-31-65(56)73(69(60)41-47)39-17-18-40-73)59-29-12-16-34-68(59)74(70)66-32-14-10-27-57(66)58-28-11-15-33-67(58)74/h2*1-14,17-38,41-45H,15-16,39-40H2;1-16,19-38,41-45H,17-18,39-40H2
InChIKeyMNFPSCVDYOWRGV-UHFFFAOYSA-N
XLogP59.32
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms225
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002856.64
LogP ≤ 559.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine with MolForge

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Related Compounds

N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138730851
3'-phenanthren-3-yl-N-spiro[cyclohexane-1,9'-fluorene]-1'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;3'-phenanthren-3-yl-N-spiro[cyclohexane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;3'-phenanthren-3-yl-N-spiro[cyclohexane-1,9'-fluorene]-3'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 159608406
3'-phenanthren-3-yl-N-spiro[cyclopentane-1,9'-fluorene]-4'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138728994
N-phenanthren-2-yl-N,3'-di(triphenylen-2-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 138728982
3'-phenyl-N-spiro[cyclohexane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138729094
3'-phenanthren-3-yl-N-(4-phenylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138729232
3'-(3-phenylphenyl)-N-spiro[cyclohexane-1,9'-fluorene]-3'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138728973
N-naphthalen-1-yl-3'-phenanthren-9-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-2-yl-3'-phenanthren-9-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-phenanthren-9-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 161355877
N-naphthalen-1-yl-3'-(4-phenanthren-3-ylphenyl)-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138729121
N-(9,9-dimethylfluoren-4-yl)-3'-phenanthren-2-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138729359
3'-(4-phenylphenyl)-N-spiro[cyclohexane-1,9'-fluorene]-1'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine
CID 138729545
N-phenanthren-9-yl-N-(4-phenylphenyl)-3'-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170448552

Frequently Asked Questions

What is the IUPAC name of N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine?
The IUPAC name of N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine (CID 159615477) is N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine.
What is the SMILES notation for N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine?
The canonical SMILES for N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine is c1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5c(ccc6ccccc65)c3)c3ccc5c6ccccc6c6ccccc6c5c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1.c1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5c6ccccc6c6ccccc6c5c3)c3cc5ccccc5c5ccccc35)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1.c1ccc2c(c1)-c1ccc(-c3cc4c(cc3N(c3ccc5ccc6ccccc6c5c3)c3ccc5c6ccccc6c6ccccc6c5c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc1C21CCCC1.
What is the InChIKey of N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine?
The InChIKey is MNFPSCVDYOWRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/3C74H49N/c1-2-18-51-46(17-1)31-32-47-41-49(34-37-52(47)51)75(50-35-38-57-55-21-4-3-19-53(55)54-20-5-6-22-56(54)64(57)43-50)72-45-71-65(44-63(72)48-33-36-62-58-23-7-11-27-66(58)73(70(62)42-48)39-15-16-40-73)61-26-10-14-30-69(61)74(71)67-28-12-8-24-59(67)60-25-9-13-29-68(60)74;1-2-18-51-46(17-1)31-32-47-33-35-49(42-62(47)51)75(50-36-38-56-54-21-4-3-19-52(54)53-20-5-6-22-55(53)64(56)43-50)72-45-71-65(44-63(72)48-34-37-61-57-23-7-11-27-66(57)73(70(61)41-48)39-15-16-40-73)60-26-10-14-30-69(60)74(71)67-28-12-8-24-58(67)59-25-9-13-29-68(59)74;1-2-20-49-46(19-1)42-71(61-30-8-7-21-50(49)61)75(48-36-38-55-53-24-4-3-22-51(53)52-23-5-6-25-54(52)63(55)43-48)72-45-70-64(44-62(72)47-35-37-60-56-26-9-13-31-65(56)73(69(60)41-47)39-17-18-40-73)59-29-12-16-34-68(59)74(70)66-32-14-10-27-57(66)58-28-11-15-33-67(58)74/h2*1-14,17-38,41-45H,15-16,39-40H2;1-16,19-38,41-45H,17-18,39-40H2.
What are the key properties of N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine?
N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine has a molecular weight of 2856.64 g/mol, XLogP of 59.32, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenanthren-2-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-3-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine;N-phenanthren-9-yl-3'-spiro[cyclopentane-1,9'-fluorene]-2'-yl-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2'-amine is sourced from PubChem (CID 159615477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).