2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine

C31H24N2 — CID 171545464

IUPAC2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine
SMILESC=CC1=C(C=C)C2(c3ccccc3-c3c(N)cccc32)c2ccccc2N1c1ccccc1
InChIInChI=1S/C31H24N2/c1-3-23-28(4-2)33(21-13-6-5-7-14-21)29-20-11-10-17-25(29)31(23)24-16-9-8-15-22(24)30-26(31)18-12-19-27(30)32/h3-20H,1-2,32H2
InChIKeyKGABWDLICWSIHG-UHFFFAOYSA-N
MW424.55 g/mol
LogP7.36
Rot. Bonds3

About 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine

2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine (PubChem CID 171545464) has the molecular formula C31H24N2 and a molecular weight of 424.55 g/mol. Its IUPAC name is 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine.

Molecular Properties

Compound Name2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine
PubChem CID171545464
Molecular FormulaC31H24N2
Molecular Weight424.55 g/mol
Exact Mass424.19
IUPAC Name2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine
SMILESC=CC1=C(C=C)C2(c3ccccc3-c3c(N)cccc32)c2ccccc2N1c1ccccc1
InChIInChI=1S/C31H24N2/c1-3-23-28(4-2)33(21-13-6-5-7-14-21)29-20-11-10-17-25(29)31(23)24-16-9-8-15-22(24)30-26(31)18-12-19-27(30)32/h3-20H,1-2,32H2
InChIKeyKGABWDLICWSIHG-UHFFFAOYSA-N
XLogP7.36
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.55
LogP ≤ 57.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2,3-bis(ethenyl)-1,4,4,10,10-pentakis-phenylindeno[1,2-g]quinoline
CID 144670337
1'-(4-carbazol-9-ylphenyl)-2',3'-bis(ethenyl)-2,7-diphenylspiro[fluorene-9,4'-quinoline]
CID 143268877
10-phenyl-2',7'-bis(10-phenylspiro[acridine-9,9'-fluorene]-2'-yl)spiro[acridine-9,9'-fluorene]
CID 102164734
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,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 134309245
N,10-diphenyl-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168805
10-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-4'-amine
CID 135166841
N-(9,9-diphenylfluoren-2-yl)-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 135168780
10-phenyl-1'-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]
CID 135293730
4'-(2-nitrophenyl)-10-phenylspiro[acridine-9,9'-fluorene]
CID 118104063
N-(4-ethenylphenyl)-9,9'-spirobi[fluorene]-4-amine
CID 146333010
10-phenyl-N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168804

Frequently Asked Questions

What is the IUPAC name of 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine?
The IUPAC name of 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine (CID 171545464) is 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine.
What is the SMILES notation for 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine?
The canonical SMILES for 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine is C=CC1=C(C=C)C2(c3ccccc3-c3c(N)cccc32)c2ccccc2N1c1ccccc1.
What is the InChIKey of 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine?
The InChIKey is KGABWDLICWSIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N2/c1-3-23-28(4-2)33(21-13-6-5-7-14-21)29-20-11-10-17-25(29)31(23)24-16-9-8-15-22(24)30-26(31)18-12-19-27(30)32/h3-20H,1-2,32H2.
What are the key properties of 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine?
2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine has a molecular weight of 424.55 g/mol, XLogP of 7.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2',3'-bis(ethenyl)-1'-phenylspiro[fluorene-9,4'-quinoline]-4-amine is sourced from PubChem (CID 171545464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).