N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine

C33H23N — CID 146333010

IUPACN-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine
SMILESC=Cc1ccc(Nc2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C33H23N/c1-2-22-18-20-23(21-19-22)34-31-17-9-16-30-32(31)26-12-5-8-15-29(26)33(30)27-13-6-3-10-24(27)25-11-4-7-14-28(25)33/h2-21,34H,1H2
InChIKeyCWJZDLJHWQRAAG-UHFFFAOYSA-N
MW433.55 g/mol
LogP8.42
Rot. Bonds3

About N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine

N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine (PubChem CID 146333010) has the molecular formula C33H23N and a molecular weight of 433.55 g/mol. Its IUPAC name is N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine.

Molecular Properties

Compound NameN-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine
PubChem CID146333010
Molecular FormulaC33H23N
Molecular Weight433.55 g/mol
Exact Mass433.18
IUPAC NameN-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine
SMILESC=Cc1ccc(Nc2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C33H23N/c1-2-22-18-20-23(21-19-22)34-31-17-9-16-30-32(31)26-12-5-8-15-29(26)33(30)27-13-6-3-10-24(27)25-11-4-7-14-28(25)33/h2-21,34H,1H2
InChIKeyCWJZDLJHWQRAAG-UHFFFAOYSA-N
XLogP8.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.55
LogP ≤ 58.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine
CID 90294631
N-(4-ethenylphenyl)-2-phenylaniline
CID 142706945
N-(4-dibenzothiophen-1-ylphenyl)-9,9'-spirobi[fluorene]-4-amine
CID 146333073
5,5-dimethyl-N-(9,9'-spirobi[fluorene]-4-yl)benzo[b][1]benzosilol-2-amine
CID 153319770
9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine
CID 146332882
N-phenyl-4-(9,9'-spirobi[fluorene]-4'-yl)naphthalen-1-amine
CID 172508818
N-(3-naphthalen-2-ylphenyl)-9,9'-spirobi[fluorene]-4-amine
CID 172544682
N-(9,9'-spirobi[fluorene]-4-yl)dibenzothiophen-4-amine
CID 171444458
N-[4-[4-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-9,9-diphenylfluoren-4-amine
CID 172544729
9,9-diphenyl-N-(2-phenylphenyl)fluoren-4-amine
CID 155297416
9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine
CID 155297478
4,6-diphenyl-N-(9,9'-spirobi[fluorene]-4-yl)dibenzofuran-1-amine
CID 172545038

Frequently Asked Questions

What is the IUPAC name of N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine?
The IUPAC name of N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine (CID 146333010) is N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine.
What is the SMILES notation for N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine?
The canonical SMILES for N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine is C=Cc1ccc(Nc2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine?
The InChIKey is CWJZDLJHWQRAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H23N/c1-2-22-18-20-23(21-19-22)34-31-17-9-16-30-32(31)26-12-5-8-15-29(26)33(30)27-13-6-3-10-24(27)25-11-4-7-14-28(25)33/h2-21,34H,1H2.
What are the key properties of N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine?
N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine has a molecular weight of 433.55 g/mol, XLogP of 8.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine is sourced from PubChem (CID 146333010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).