2-bromo-6-fluoro-N-methylaniline

C7H7BrFN — CID 21161540

IUPAC2-bromo-6-fluoro-N-methylaniline
SMILESCNc1c(F)cccc1Br
InChIInChI=1S/C7H7BrFN/c1-10-7-5(8)3-2-4-6(7)9/h2-4,10H,1H3
InChIKeyVXJNBFLTPCRHEN-UHFFFAOYSA-N
MW204.04 g/mol
LogP2.63
Rot. Bonds1

About 2-bromo-6-fluoro-N-methylaniline

2-bromo-6-fluoro-N-methylaniline (PubChem CID 21161540) has the molecular formula C7H7BrFN and a molecular weight of 204.04 g/mol. Its IUPAC name is 2-bromo-6-fluoro-N-methylaniline.

Molecular Properties

Compound Name2-bromo-6-fluoro-N-methylaniline
PubChem CID21161540
Molecular FormulaC7H7BrFN
Molecular Weight204.04 g/mol
Exact Mass202.97
IUPAC Name2-bromo-6-fluoro-N-methylaniline
SMILESCNc1c(F)cccc1Br
InChIInChI=1S/C7H7BrFN/c1-10-7-5(8)3-2-4-6(7)9/h2-4,10H,1H3
InChIKeyVXJNBFLTPCRHEN-UHFFFAOYSA-N
XLogP2.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.04
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-6-fluoro-N-propan-2-ylaniline
CID 103747956
N-(2-bromo-6-fluorophenyl)acetamide
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3-fluoro-1-N,2-N-dimethylbenzene-1,2-diamine
CID 69472911
2-fluoro-N,6-dimethylaniline;hydrochloride
CID 167737520
N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide
CID 107601184
2-bromo-6-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline
CID 107598513
(2R)-1-(2-bromo-6-fluoroanilino)propan-2-ol
CID 107599492
2-ethyl-6-fluoro-N-methylaniline
CID 22769633
2-bromo-6-fluoro-N-[1-(4-propan-2-ylphenyl)ethyl]aniline
CID 107597769
methyl 2-(2-bromo-6-fluoroanilino)-2-oxoacetate
CID 107602508
N-(2-bromo-6-fluorophenyl)-3-(methylamino)propane-1-sulfonamide
CID 106089645
2-bromo-6-fluoro-N-nonan-2-ylaniline
CID 107597794

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-fluoro-N-methylaniline?
The IUPAC name of 2-bromo-6-fluoro-N-methylaniline (CID 21161540) is 2-bromo-6-fluoro-N-methylaniline.
What is the SMILES notation for 2-bromo-6-fluoro-N-methylaniline?
The canonical SMILES for 2-bromo-6-fluoro-N-methylaniline is CNc1c(F)cccc1Br.
What is the InChIKey of 2-bromo-6-fluoro-N-methylaniline?
The InChIKey is VXJNBFLTPCRHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrFN/c1-10-7-5(8)3-2-4-6(7)9/h2-4,10H,1H3.
What are the key properties of 2-bromo-6-fluoro-N-methylaniline?
2-bromo-6-fluoro-N-methylaniline has a molecular weight of 204.04 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-fluoro-N-methylaniline is sourced from PubChem (CID 21161540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).