9-(2,3-difluorophenyl)-3,6-dimethylcarbazole

C20H15F2N — CID 122431603

IUPAC9-(2,3-difluorophenyl)-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(F)c1F
InChIInChI=1S/C20H15F2N/c1-12-6-8-17-14(10-12)15-11-13(2)7-9-18(15)23(17)19-5-3-4-16(21)20(19)22/h3-11H,1-2H3
InChIKeyDYKWFQPYATUSCV-UHFFFAOYSA-N
MW307.34 g/mol
LogP5.68
Rot. Bonds1

About 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole

9-(2,3-difluorophenyl)-3,6-dimethylcarbazole (PubChem CID 122431603) has the molecular formula C20H15F2N and a molecular weight of 307.34 g/mol. Its IUPAC name is 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole.

Molecular Properties

Compound Name9-(2,3-difluorophenyl)-3,6-dimethylcarbazole
PubChem CID122431603
Molecular FormulaC20H15F2N
Molecular Weight307.34 g/mol
Exact Mass307.12
IUPAC Name9-(2,3-difluorophenyl)-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(F)c1F
InChIInChI=1S/C20H15F2N/c1-12-6-8-17-14(10-12)15-11-13(2)7-9-18(15)23(17)19-5-3-4-16(21)20(19)22/h3-11H,1-2H3
InChIKeyDYKWFQPYATUSCV-UHFFFAOYSA-N
XLogP5.68
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.34
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,6-dimethyl-9-(2,3,4-trifluorophenyl)carbazole
CID 146656308
9-[3-fluoro-2-(trifluoromethyl)phenyl]-3,6-dimethylcarbazole
CID 122431595
2-fluoro-9-(2-fluorophenyl)-3,6-dimethylcarbazole
CID 146656306
3-methyl-9-[2-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 58771355
9-[4-(2,6-difluorophenyl)-2-methyl-3-(3-methylcarbazol-9-yl)phenyl]-3-methylcarbazole
CID 158882715
3,6-dimethyl-9-[2-[2-(3-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170060425
9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole
CID 170201849
2,4-difluoro-3,6-dimethyl-9-(2,3,5-trifluoro-4-methylphenyl)carbazole
CID 146656336
azane;1-fluoro-7-methylnaphthalene
CID 174703926
3-methyl-9-[3-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 59399075
2-(3,6-dimethylcarbazol-9-yl)benzonitrile
CID 175004217
1-fluoro-3,6-dimethyl-9-(2,3,5-trifluoro-4-methylphenyl)carbazole
CID 146656334

Frequently Asked Questions

What is the IUPAC name of 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole?
The IUPAC name of 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole (CID 122431603) is 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole.
What is the SMILES notation for 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole?
The canonical SMILES for 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole is Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(F)c1F.
What is the InChIKey of 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole?
The InChIKey is DYKWFQPYATUSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N/c1-12-6-8-17-14(10-12)15-11-13(2)7-9-18(15)23(17)19-5-3-4-16(21)20(19)22/h3-11H,1-2H3.
What are the key properties of 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole?
9-(2,3-difluorophenyl)-3,6-dimethylcarbazole has a molecular weight of 307.34 g/mol, XLogP of 5.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,3-difluorophenyl)-3,6-dimethylcarbazole is sourced from PubChem (CID 122431603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).