2-(difluoromethyl)-9H-carbazole

C13H9F2N — CID 46855212

IUPAC2-(difluoromethyl)-9H-carbazole
SMILESFC(F)c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C13H9F2N/c14-13(15)8-5-6-10-9-3-1-2-4-11(9)16-12(10)7-8/h1-7,13,16H
InChIKeyJHTSEXLNQMISRI-UHFFFAOYSA-N
MW217.22 g/mol
LogP4.26
Rot. Bonds1

About 2-(difluoromethyl)-9H-carbazole

2-(difluoromethyl)-9H-carbazole (PubChem CID 46855212) has the molecular formula C13H9F2N and a molecular weight of 217.22 g/mol. Its IUPAC name is 2-(difluoromethyl)-9H-carbazole.

Molecular Properties

Compound Name2-(difluoromethyl)-9H-carbazole
PubChem CID46855212
Molecular FormulaC13H9F2N
Molecular Weight217.22 g/mol
Exact Mass217.07
IUPAC Name2-(difluoromethyl)-9H-carbazole
SMILESFC(F)c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C13H9F2N/c14-13(15)8-5-6-10-9-3-1-2-4-11(9)16-12(10)7-8/h1-7,13,16H
InChIKeyJHTSEXLNQMISRI-UHFFFAOYSA-N
XLogP4.26
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

Carbazole
CID 6854
7H-Dibenzo(c,g)carbazole
CID 9134
Tetrahydro-beta-carboline
CID 107838
2-Methylindole
CID 7224
2,3-Dimethylindole
CID 7053
2-Phenylindole
CID 13698
3-Amino-9-ethylcarbazole
CID 8588
2-Methyl-1,2,3,4-tetrahydro-beta-carboline
CID 121896
4,9-Dihydro-1-methyl-3H-pyrido(3,4-b)indole
CID 160510
4',6-Diamidino-2-Phenylindole
CID 2954
2,3-diphenyl-1H-indole
CID 77020
6-Fluoro-3-((1E)-2-(3-pyridinyl)ethenyl)-1H-indole
CID 10014426

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-9H-carbazole?
The IUPAC name of 2-(difluoromethyl)-9H-carbazole (CID 46855212) is 2-(difluoromethyl)-9H-carbazole.
What is the SMILES notation for 2-(difluoromethyl)-9H-carbazole?
The canonical SMILES for 2-(difluoromethyl)-9H-carbazole is FC(F)c1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 2-(difluoromethyl)-9H-carbazole?
The InChIKey is JHTSEXLNQMISRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2N/c14-13(15)8-5-6-10-9-3-1-2-4-11(9)16-12(10)7-8/h1-7,13,16H.
What are the key properties of 2-(difluoromethyl)-9H-carbazole?
2-(difluoromethyl)-9H-carbazole has a molecular weight of 217.22 g/mol, XLogP of 4.26, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-9H-carbazole is sourced from PubChem (CID 46855212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).