1-(3-carbazol-9-ylcarbazol-9-yl)ethanone

C26H18N2O — CID 118391781

IUPAC1-(3-carbazol-9-ylcarbazol-9-yl)ethanone
SMILESCC(=O)n1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)ccc21
InChIInChI=1S/C26H18N2O/c1-17(29)27-23-11-5-4-10-21(23)22-16-18(14-15-26(22)27)28-24-12-6-2-8-19(24)20-9-3-7-13-25(20)28/h2-16H,1H3
InChIKeyZGYFBEUXZRTYSZ-UHFFFAOYSA-N
MW374.44 g/mol
LogP6.55
Rot. Bonds1

About 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone

1-(3-carbazol-9-ylcarbazol-9-yl)ethanone (PubChem CID 118391781) has the molecular formula C26H18N2O and a molecular weight of 374.44 g/mol. Its IUPAC name is 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone.

Molecular Properties

Compound Name1-(3-carbazol-9-ylcarbazol-9-yl)ethanone
PubChem CID118391781
Molecular FormulaC26H18N2O
Molecular Weight374.44 g/mol
Exact Mass374.14
IUPAC Name1-(3-carbazol-9-ylcarbazol-9-yl)ethanone
SMILESCC(=O)n1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)ccc21
InChIInChI=1S/C26H18N2O/c1-17(29)27-23-11-5-4-10-21(23)22-16-18(14-15-26(22)27)28-24-12-6-2-8-19(24)20-9-3-7-13-25(20)28/h2-16H,1H3
InChIKeyZGYFBEUXZRTYSZ-UHFFFAOYSA-N
XLogP6.55
TPSA26.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.44
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(6-carbazol-9-yl-9H-fluoren-3-yl)carbazole;1-[3,6-di(carbazol-9-yl)carbazol-9-yl]ethanone
CID 160891883
1-carbazol-9-ylethanone;ethane
CID 142183368
bis[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]methanone
CID 102359107
3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
3-carbazol-9-yl-9-phenylcarbazole;ethane
CID 145117169
3-carbazol-9-yl-9-[9-(2-carbazol-9-ylphenyl)carbazol-3-yl]carbazole
CID 167209844
4-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]benzaldehyde
CID 24814953
N-(9-acetylcarbazol-3-yl)acetamide
CID 3326945
2-carbazol-9-yl-9-(9-triphenylen-2-ylcarbazol-3-yl)carbazole
CID 121274428
9-[6,10-di(carbazol-9-yl)triphenylen-2-yl]carbazole
CID 122548627
2-(3-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121274440
3-carbazol-9-yl-9-(6-carbazol-9-yltetraphenylen-2-yl)carbazole
CID 168811183

Frequently Asked Questions

What is the IUPAC name of 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone?
The IUPAC name of 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone (CID 118391781) is 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone.
What is the SMILES notation for 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone?
The canonical SMILES for 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone is CC(=O)n1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)ccc21.
What is the InChIKey of 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone?
The InChIKey is ZGYFBEUXZRTYSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2O/c1-17(29)27-23-11-5-4-10-21(23)22-16-18(14-15-26(22)27)28-24-12-6-2-8-19(24)20-9-3-7-13-25(20)28/h2-16H,1H3.
What are the key properties of 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone?
1-(3-carbazol-9-ylcarbazol-9-yl)ethanone has a molecular weight of 374.44 g/mol, XLogP of 6.55, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-carbazol-9-ylcarbazol-9-yl)ethanone is sourced from PubChem (CID 118391781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).