10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]

C50H33N5 — CID 154952867

IUPAC10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]
SMILESc1ccc(-n2c(-c3ccc(N4c5ccccc5C5(c6ccccc6-c6ccccc65)c5ccccc54)cc3)nc(-c3ccccn3)c2-c2ccccn2)cc1
InChIInChI=1S/C50H33N5/c1-2-16-35(17-3-1)55-48(44-25-13-15-33-52-44)47(43-24-12-14-32-51-43)53-49(55)34-28-30-36(31-29-34)54-45-26-10-8-22-41(45)50(42-23-9-11-27-46(42)54)39-20-6-4-18-37(39)38-19-5-7-21-40(38)50/h1-33H
InChIKeyJELSKHSGZGGREI-UHFFFAOYSA-N
MW703.85 g/mol
LogP11.81
Rot. Bonds5

About 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]

10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene] (PubChem CID 154952867) has the molecular formula C50H33N5 and a molecular weight of 703.85 g/mol. Its IUPAC name is 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene].

Molecular Properties

Compound Name10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]
PubChem CID154952867
Molecular FormulaC50H33N5
Molecular Weight703.85 g/mol
Exact Mass703.27
IUPAC Name10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]
SMILESc1ccc(-n2c(-c3ccc(N4c5ccccc5C5(c6ccccc6-c6ccccc65)c5ccccc54)cc3)nc(-c3ccccn3)c2-c2ccccn2)cc1
InChIInChI=1S/C50H33N5/c1-2-16-35(17-3-1)55-48(44-25-13-15-33-52-44)47(43-24-12-14-32-51-43)53-49(55)34-28-30-36(31-29-34)54-45-26-10-8-22-41(45)50(42-23-9-11-27-46(42)54)39-20-6-4-18-37(39)38-19-5-7-21-40(38)50/h1-33H
InChIKeyJELSKHSGZGGREI-UHFFFAOYSA-N
XLogP11.81
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500703.85
LogP ≤ 511.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]phenothiazine
CID 147241998
2-tert-butyl-9,9-dimethyl-10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]acridine
CID 154952703
acetic acid;4-(9,9-dimethylacridin-10-yl)benzaldehyde;9,9-dimethyl-10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]acridine;1,2-dipyridin-2-ylethane-1,2-dione
CID 157475136
10-[4-[1-(4-cyclohexa-2,4-dien-1-ylphenyl)-4,5-dipyridin-2-ylimidazol-2-yl]phenyl]-9,9-dimethylacridine
CID 163749587
10-phenyl-2',7'-bis(10-phenylspiro[acridine-9,9'-fluorene]-2'-yl)spiro[acridine-9,9'-fluorene]
CID 102164734
2'-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]
CID 129263896
2'-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-10-phenylspiro[acridine-9,9'-fluorene]
CID 139521181
10-[2-(4-phenyl-6-pyridin-2-ylpyrimidin-2-yl)phenyl]spiro[acridine-9,9'-fluorene]
CID 146653899
10-phenyl-4'-[4-phenyl-3-[4-phenyl-6-[4-(4-spiro[acridine-9,9'-fluorene]-10-ylphenyl)phenyl]pyrimidin-2-yl]phenyl]-3-[4-[6-phenyl-2-(3-pyridin-2-ylphenyl)pyrimidin-4-yl]phenyl]spiro[acridine-9,9'-fluorene]
CID 167177913
2'-(2,6-diphenylpyrimidin-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]
CID 129263417
6',8'-diphenyl-10'-[4-(2-phenylquinazolin-4-yl)phenyl]spiro[fluorene-9,13'-quinolino[4,3-b]acridine];10'-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6',8'-diphenylspiro[fluorene-9,13'-quinolino[4,3-b]acridine]
CID 163991655
2'-(4,6-diphenylpyrimidin-2-yl)-10-phenyl-7'-[4-(1-phenylbenzimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]
CID 118688217

Frequently Asked Questions

What is the IUPAC name of 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]?
The IUPAC name of 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene] (CID 154952867) is 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene].
What is the SMILES notation for 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]?
The canonical SMILES for 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene] is c1ccc(-n2c(-c3ccc(N4c5ccccc5C5(c6ccccc6-c6ccccc65)c5ccccc54)cc3)nc(-c3ccccn3)c2-c2ccccn2)cc1.
What is the InChIKey of 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]?
The InChIKey is JELSKHSGZGGREI-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H33N5/c1-2-16-35(17-3-1)55-48(44-25-13-15-33-52-44)47(43-24-12-14-32-51-43)53-49(55)34-28-30-36(31-29-34)54-45-26-10-8-22-41(45)50(42-23-9-11-27-46(42)54)39-20-6-4-18-37(39)38-19-5-7-21-40(38)50/h1-33H.
What are the key properties of 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene]?
10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene] has a molecular weight of 703.85 g/mol, XLogP of 11.81, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-(1-phenyl-4,5-dipyridin-2-ylimidazol-2-yl)phenyl]spiro[acridine-9,9'-fluorene] is sourced from PubChem (CID 154952867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).