6-bromo-3-fluoro-1-methyl-1H-carbazole

C13H9BrFN — CID 150527151

IUPAC6-bromo-3-fluoro-1-methyl-1H-carbazole
SMILESCC1C=C(F)C=C2C1=Nc1ccc(Br)cc12
InChIInChI=1S/C13H9BrFN/c1-7-4-9(15)6-11-10-5-8(14)2-3-12(10)16-13(7)11/h2-7H,1H3
InChIKeyIDBCZSPQFKMRBQ-UHFFFAOYSA-N
MW278.12 g/mol
LogP4.42
Rot. Bonds

About 6-bromo-3-fluoro-1-methyl-1H-carbazole

6-bromo-3-fluoro-1-methyl-1H-carbazole (PubChem CID 150527151) has the molecular formula C13H9BrFN and a molecular weight of 278.12 g/mol. Its IUPAC name is 6-bromo-3-fluoro-1-methyl-1H-carbazole.

Molecular Properties

Compound Name6-bromo-3-fluoro-1-methyl-1H-carbazole
PubChem CID150527151
Molecular FormulaC13H9BrFN
Molecular Weight278.12 g/mol
Exact Mass276.99
IUPAC Name6-bromo-3-fluoro-1-methyl-1H-carbazole
SMILESCC1C=C(F)C=C2C1=Nc1ccc(Br)cc12
InChIInChI=1S/C13H9BrFN/c1-7-4-9(15)6-11-10-5-8(14)2-3-12(10)16-13(7)11/h2-7H,1H3
InChIKeyIDBCZSPQFKMRBQ-UHFFFAOYSA-N
XLogP4.42
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.12
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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2-[(E)-2-(4-bromophenyl)ethenyl]-3,3-dimethylindole
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7-bromo-2,3,3-trimethyl-3H-indole
CID 20553392
4-Bromo-2-ethylphenyl isocyanate
CID 4426496
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CID 155490362
Benzenamine, 4-bromo-N-(1-phenylethylidene)-
CID 11637633
Benzenamine, N-[1-(3-bromophenyl)ethylidene]-
CID 12176205
6-Bromo-4a-methyl-2,3,4,4a-tetrahydro-1h-carbazole
CID 15850054
4-bromo-2,3,3-trimethyl-3H-indole
CID 67262749
5'-Bromospiro[cyclohexane-1,3'-indole]
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CID 86811096

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-fluoro-1-methyl-1H-carbazole?
The IUPAC name of 6-bromo-3-fluoro-1-methyl-1H-carbazole (CID 150527151) is 6-bromo-3-fluoro-1-methyl-1H-carbazole.
What is the SMILES notation for 6-bromo-3-fluoro-1-methyl-1H-carbazole?
The canonical SMILES for 6-bromo-3-fluoro-1-methyl-1H-carbazole is CC1C=C(F)C=C2C1=Nc1ccc(Br)cc12.
What is the InChIKey of 6-bromo-3-fluoro-1-methyl-1H-carbazole?
The InChIKey is IDBCZSPQFKMRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrFN/c1-7-4-9(15)6-11-10-5-8(14)2-3-12(10)16-13(7)11/h2-7H,1H3.
What are the key properties of 6-bromo-3-fluoro-1-methyl-1H-carbazole?
6-bromo-3-fluoro-1-methyl-1H-carbazole has a molecular weight of 278.12 g/mol, XLogP of 4.42, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-fluoro-1-methyl-1H-carbazole is sourced from PubChem (CID 150527151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).