N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine

C56H40N2 — CID 155240889

IUPACN-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4ccccc4c3)c3cccc4c3-c3ccccc3C43c4ccccc4N(c4ccccc4)c4ccccc43)cc21
InChIInChI=1S/C56H40N2/c1-55(2)45-23-10-8-21-42(45)43-34-33-41(36-50(43)55)57(40-32-31-37-17-6-7-18-38(37)35-40)53-30-16-27-49-54(53)44-22-9-11-24-46(44)56(49)47-25-12-14-28-51(47)58(39-19-4-3-5-20-39)52-29-15-13-26-48(52)56/h3-36H,1-2H3
InChIKeyFOBBKNUXCXLVNH-UHFFFAOYSA-N
MW740.95 g/mol
LogP14.76
Rot. Bonds4

About N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine

N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine (PubChem CID 155240889) has the molecular formula C56H40N2 and a molecular weight of 740.95 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
PubChem CID155240889
Molecular FormulaC56H40N2
Molecular Weight740.95 g/mol
Exact Mass740.32
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4ccccc4c3)c3cccc4c3-c3ccccc3C43c4ccccc4N(c4ccccc4)c4ccccc43)cc21
InChIInChI=1S/C56H40N2/c1-55(2)45-23-10-8-21-42(45)43-34-33-41(36-50(43)55)57(40-32-31-37-17-6-7-18-38(37)35-40)53-30-16-27-49-54(53)44-22-9-11-24-46(44)56(49)47-25-12-14-28-51(47)58(39-19-4-3-5-20-39)52-29-15-13-26-48(52)56/h3-36H,1-2H3
InChIKeyFOBBKNUXCXLVNH-UHFFFAOYSA-N
XLogP14.76
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.95
LogP ≤ 514.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,10-diphenyl-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168805
N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168927
N-naphthalen-2-yl-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135166670
10-phenyl-N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168804
N-(9,9-dimethylfluoren-4-yl)-10-phenyl-N-[2-(3-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135166608
N-(9,9-diphenylfluoren-2-yl)-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 135168780
N-(9,9-dimethylfluoren-2-yl)-N,10-diphenylspiro[acridine-9,9'-fluorene]-2'-amine
CID 134309240
N-(9,9-dimethylfluoren-2-yl)-N-[4-[3-[4-[3-[4'-[4-(3,5-diphenylphenyl)-N-(9-methyl-9-phenylfluoren-2-yl)anilino]spiro[acridine-9,9'-fluorene]-10-yl]phenyl]phenyl]-5-phenylphenyl]phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 155240389
N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 134309245
N-naphthalen-2-yl-10-phenyl-N-[2-(3-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine;10-phenyl-N-(2-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine;10-phenyl-N-(3-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine
CID 159690363
N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168816
2-N,5-N-bis(9,9-dimethylfluoren-2-yl)-2-N,5-N-diphenyl-9,9'-spirobi[fluorene]-2,5-diamine
CID 137448787

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine (CID 155240889) is N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4ccccc4c3)c3cccc4c3-c3ccccc3C43c4ccccc4N(c4ccccc4)c4ccccc43)cc21.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?
The InChIKey is FOBBKNUXCXLVNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H40N2/c1-55(2)45-23-10-8-21-42(45)43-34-33-41(36-50(43)55)57(40-32-31-37-17-6-7-18-38(37)35-40)53-30-16-27-49-54(53)44-22-9-11-24-46(44)56(49)47-25-12-14-28-51(47)58(39-19-4-3-5-20-39)52-29-15-13-26-48(52)56/h3-36H,1-2H3.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?
N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine has a molecular weight of 740.95 g/mol, XLogP of 14.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine is sourced from PubChem (CID 155240889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).