1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene

C56H44N2 — CID 145237212

IUPAC1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene
SMILESC=C(/N=C(\C)c1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccccc1.C=C(C)c1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H22N2.C28H22/c1-20(22-10-4-3-5-11-22)29-21(2)23-16-18-24(19-17-23)30-27-14-8-6-12-25(27)26-13-7-9-15-28(26)30;1-20(2)23-17-11-19-26-27(23)24-16-9-10-18-25(24)28(26,21-12-5-3-6-13-21)22-14-7-4-8-15-22/h3-19H,1H2,2H3;3-19H,1H2,2H3/b29-21+;
InChIKeyXPLKGNMZAPIWPR-ORVJAXSGSA-N
MW744.98 g/mol
LogP14.35
Rot. Bonds7

About 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene

1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene (PubChem CID 145237212) has the molecular formula C56H44N2 and a molecular weight of 744.98 g/mol. Its IUPAC name is 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene.

Molecular Properties

Compound Name1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene
PubChem CID145237212
Molecular FormulaC56H44N2
Molecular Weight744.98 g/mol
Exact Mass744.35
IUPAC Name1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene
SMILESC=C(/N=C(\C)c1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccccc1.C=C(C)c1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H22N2.C28H22/c1-20(22-10-4-3-5-11-22)29-21(2)23-16-18-24(19-17-23)30-27-14-8-6-12-25(27)26-13-7-9-15-28(26)30;1-20(2)23-17-11-19-26-27(23)24-16-9-10-18-25(24)28(26,21-12-5-3-6-13-21)22-14-7-4-8-15-22/h3-19H,1H2,2H3;3-19H,1H2,2H3/b29-21+;
InChIKeyXPLKGNMZAPIWPR-ORVJAXSGSA-N
XLogP14.35
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500744.98
LogP ≤ 514.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

20-[4-(9,9-diphenylfluoren-4-yl)phenyl]-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14,16,18,21,23-dodecaene
CID 134580544
9-[4-[4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 126543721
N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)-9,9'-spirobi[fluorene]-2-amine
CID 121423436
methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
CID 158348177
5-[4-(4-carbazol-9-ylphenyl)phenyl]-11,11-diphenylindeno[1,2-b]carbazole
CID 168783626
2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole
CID 90216123
N-(4-carbazol-9-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-diphenylfluoren-4-amine
CID 126548866
7-carbazol-9-yl-N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine
CID 135193232
14,14-diphenyl-9-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;11,11-diphenyl-5-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]indeno[1,2-b]carbazole
CID 161419059
7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine
CID 135193235
9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole
CID 67326563
4-carbazol-9-yl-N,N-diethylaniline;4-(4-carbazol-9-ylphenyl)-N,N-diethylaniline;bis(9,9-diphenylfluorene);ethane
CID 160998425

Frequently Asked Questions

What is the IUPAC name of 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene?
The IUPAC name of 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene (CID 145237212) is 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene.
What is the SMILES notation for 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene?
The canonical SMILES for 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene is C=C(/N=C(\C)c1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccccc1.C=C(C)c1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene?
The InChIKey is XPLKGNMZAPIWPR-ORVJAXSGSA-N. The full InChI is InChI=1S/C28H22N2.C28H22/c1-20(22-10-4-3-5-11-22)29-21(2)23-16-18-24(19-17-23)30-27-14-8-6-12-25(27)26-13-7-9-15-28(26)30;1-20(2)23-17-11-19-26-27(23)24-16-9-10-18-25(24)28(26,21-12-5-3-6-13-21)22-14-7-4-8-15-22/h3-19H,1H2,2H3;3-19H,1H2,2H3/b29-21+;.
What are the key properties of 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene?
1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene has a molecular weight of 744.98 g/mol, XLogP of 14.35, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-carbazol-9-ylphenyl)-N-(1-phenylethenyl)ethanimine;9,9-diphenyl-4-prop-1-en-2-ylfluorene is sourced from PubChem (CID 145237212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).