9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine

C48H37N — CID 153470826

IUPAC9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4ccccc4-c4ccc5c(c4)C4(CCCC4)c4ccccc4-5)cc32)cc1
InChIInChI=1S/C48H37N/c1-3-15-34(16-4-1)48(35-17-5-2-6-18-35)43-23-11-8-21-39(43)41-28-26-36(32-45(41)48)49-46-24-12-9-19-37(46)33-25-27-40-38-20-7-10-22-42(38)47(44(40)31-33)29-13-14-30-47/h1-12,15-28,31-32,49H,13-14,29-30H2
InChIKeyCPKWTFWIXNLFEM-UHFFFAOYSA-N
MW627.83 g/mol
LogP12.30
Rot. Bonds5

About 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine

9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine (PubChem CID 153470826) has the molecular formula C48H37N and a molecular weight of 627.83 g/mol. Its IUPAC name is 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine
PubChem CID153470826
Molecular FormulaC48H37N
Molecular Weight627.83 g/mol
Exact Mass627.29
IUPAC Name9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4ccccc4-c4ccc5c(c4)C4(CCCC4)c4ccccc4-5)cc32)cc1
InChIInChI=1S/C48H37N/c1-3-15-34(16-4-1)48(35-17-5-2-6-18-35)43-23-11-8-21-39(43)41-28-26-36(32-45(41)48)49-46-24-12-9-19-37(46)33-25-27-40-38-20-7-10-22-42(38)47(44(40)31-33)29-13-14-30-47/h1-12,15-28,31-32,49H,13-14,29-30H2
InChIKeyCPKWTFWIXNLFEM-UHFFFAOYSA-N
XLogP12.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500627.83
LogP ≤ 512.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-phenylphenyl)spiro[cyclopentane-1,9'-fluorene]-2'-amine
CID 58672380
N-phenylspiro[cyclopentane-1,9'-fluorene]-2'-amine
CID 58672316
9,9-diphenyl-N-(2-phenylphenyl)fluoren-3-amine
CID 155297414
N-[3-(anilinomethyl)phenyl]-2-(9,9-diphenylfluoren-2-yl)aniline
CID 118534522
9,9-diphenylfluorene;9,9'-spirobi[fluorene];spiro[cyclopentane-1,9'-fluorene]
CID 159194629
N-(2-chlorophenyl)-9,9-diphenylfluoren-2-amine
CID 126695799
N-phenyl-2-[4-(9-phenylfluoren-9-yl)phenyl]aniline
CID 165158428
N-(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-2-amine
CID 121423904
2'-phenylspiro[cyclohexane-1,9'-fluorene]
CID 123183554
N-[3-(9-phenylfluoren-9-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 138519337
N-(2-phenylphenyl)spiro[6,7-dihydrofluorene-9,9'-fluorene]-2-amine
CID 123741580
9,9-diphenyl-N-(4-triphenylsilylphenyl)fluoren-2-amine
CID 175823474

Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine?
The IUPAC name of 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine (CID 153470826) is 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine.
What is the SMILES notation for 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine?
The canonical SMILES for 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4ccccc4-c4ccc5c(c4)C4(CCCC4)c4ccccc4-5)cc32)cc1.
What is the InChIKey of 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine?
The InChIKey is CPKWTFWIXNLFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H37N/c1-3-15-34(16-4-1)48(35-17-5-2-6-18-35)43-23-11-8-21-39(43)41-28-26-36(32-45(41)48)49-46-24-12-9-19-37(46)33-25-27-40-38-20-7-10-22-42(38)47(44(40)31-33)29-13-14-30-47/h1-12,15-28,31-32,49H,13-14,29-30H2.
What are the key properties of 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine?
9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine has a molecular weight of 627.83 g/mol, XLogP of 12.30, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diphenyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)fluoren-2-amine is sourced from PubChem (CID 153470826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).