4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine

C75H56N6 — CID 58881157

IUPAC4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine
SMILESCC1(C)c2cc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7cc(-c8ccccn8)nc(-c8ccccn8)c7)ccc5-6)ccc3-4)cc21
InChIInChI=1S/C75H56N6/c1-73(2)59-35-45(47-21-27-55-57-29-23-49(39-63(57)74(3,4)61(55)37-47)51-41-69(65-15-7-11-31-76-65)80-70(42-51)66-16-8-12-32-77-66)19-25-53(59)54-26-20-46(36-60(54)73)48-22-28-56-58-30-24-50(40-64(58)75(5,6)62(56)38-48)52-43-71(67-17-9-13-33-78-67)81-72(44-52)68-18-10-14-34-79-68/h7-44H,1-6H3
InChIKeyIWWYBJJMVCTTDV-UHFFFAOYSA-N
MW1041.32 g/mol
LogP18.31
Rot. Bonds8

About 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine

4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine (PubChem CID 58881157) has the molecular formula C75H56N6 and a molecular weight of 1041.32 g/mol. Its IUPAC name is 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine.

Molecular Properties

Compound Name4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine
PubChem CID58881157
Molecular FormulaC75H56N6
Molecular Weight1041.32 g/mol
Exact Mass1040.46
IUPAC Name4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine
SMILESCC1(C)c2cc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7cc(-c8ccccn8)nc(-c8ccccn8)c7)ccc5-6)ccc3-4)cc21
InChIInChI=1S/C75H56N6/c1-73(2)59-35-45(47-21-27-55-57-29-23-49(39-63(57)74(3,4)61(55)37-47)51-41-69(65-15-7-11-31-76-65)80-70(42-51)66-16-8-12-32-77-66)19-25-53(59)54-26-20-46(36-60(54)73)48-22-28-56-58-30-24-50(40-64(58)75(5,6)62(56)38-48)52-43-71(67-17-9-13-33-78-67)81-72(44-52)68-18-10-14-34-79-68/h7-44H,1-6H3
InChIKeyIWWYBJJMVCTTDV-UHFFFAOYSA-N
XLogP18.31
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms81
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001041.32
LogP ≤ 518.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine?
The IUPAC name of 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine (CID 58881157) is 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine.
What is the SMILES notation for 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine?
The canonical SMILES for 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine is CC1(C)c2cc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7cc(-c8ccccn8)nc(-c8ccccn8)c7)ccc5-6)ccc3-4)cc21.
What is the InChIKey of 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine?
The InChIKey is IWWYBJJMVCTTDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H56N6/c1-73(2)59-35-45(47-21-27-55-57-29-23-49(39-63(57)74(3,4)61(55)37-47)51-41-69(65-15-7-11-31-76-65)80-70(42-51)66-16-8-12-32-77-66)19-25-53(59)54-26-20-46(36-60(54)73)48-22-28-56-58-30-24-50(40-64(58)75(5,6)62(56)38-48)52-43-71(67-17-9-13-33-78-67)81-72(44-52)68-18-10-14-34-79-68/h7-44H,1-6H3.
What are the key properties of 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine?
4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine has a molecular weight of 1041.32 g/mol, XLogP of 18.31, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-[7-[7-(2,6-dipyridin-2-yl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,6-dipyridin-2-ylpyridine is sourced from PubChem (CID 58881157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).