1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole

C19H11F3N2 — CID 68760063

IUPAC1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole
SMILESFC(F)(F)c1cccc2[nH]c3cc4[nH]c5ccccc5c4cc3c12
InChIInChI=1S/C19H11F3N2/c20-19(21,22)13-5-3-7-15-18(13)12-8-11-10-4-1-2-6-14(10)23-16(11)9-17(12)24-15/h1-9,23-24H
InChIKeyVJYNSYXFWFJAJI-UHFFFAOYSA-N
MW324.31 g/mol
LogP5.97
Rot. Bonds

About 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole

1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole (PubChem CID 68760063) has the molecular formula C19H11F3N2 and a molecular weight of 324.31 g/mol. Its IUPAC name is 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole.

Molecular Properties

Compound Name1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole
PubChem CID68760063
Molecular FormulaC19H11F3N2
Molecular Weight324.31 g/mol
Exact Mass324.09
IUPAC Name1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole
SMILESFC(F)(F)c1cccc2[nH]c3cc4[nH]c5ccccc5c4cc3c12
InChIInChI=1S/C19H11F3N2/c20-19(21,22)13-5-3-7-15-18(13)12-8-11-10-4-1-2-6-14(10)23-16(11)9-17(12)24-15/h1-9,23-24H
InChIKeyVJYNSYXFWFJAJI-UHFFFAOYSA-N
XLogP5.97
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.31
LogP ≤ 55.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole?
The IUPAC name of 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole (CID 68760063) is 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole.
What is the SMILES notation for 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole?
The canonical SMILES for 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole is FC(F)(F)c1cccc2[nH]c3cc4[nH]c5ccccc5c4cc3c12.
What is the InChIKey of 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole?
The InChIKey is VJYNSYXFWFJAJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11F3N2/c20-19(21,22)13-5-3-7-15-18(13)12-8-11-10-4-1-2-6-14(10)23-16(11)9-17(12)24-15/h1-9,23-24H.
What are the key properties of 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole?
1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole has a molecular weight of 324.31 g/mol, XLogP of 5.97, 0 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole is sourced from PubChem (CID 68760063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).