6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine

C11H9BrFN3 — CID 62914654

IUPAC6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine
SMILESCNc1ccc(-c2ccc(F)c(Br)c2)nn1
InChIInChI=1S/C11H9BrFN3/c1-14-11-5-4-10(15-16-11)7-2-3-9(13)8(12)6-7/h2-6H,1H3,(H,14,16)
InChIKeyRUGXKUFBOMPZKB-UHFFFAOYSA-N
MW282.12 g/mol
LogP3.09
Rot. Bonds2

About 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine

6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine (PubChem CID 62914654) has the molecular formula C11H9BrFN3 and a molecular weight of 282.12 g/mol. Its IUPAC name is 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine
PubChem CID62914654
Molecular FormulaC11H9BrFN3
Molecular Weight282.12 g/mol
Exact Mass281.00
IUPAC Name6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine
SMILESCNc1ccc(-c2ccc(F)c(Br)c2)nn1
InChIInChI=1S/C11H9BrFN3/c1-14-11-5-4-10(15-16-11)7-2-3-9(13)8(12)6-7/h2-6H,1H3,(H,14,16)
InChIKeyRUGXKUFBOMPZKB-UHFFFAOYSA-N
XLogP3.09
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.12
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine
CID 62203035
N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine
CID 116973158
6-(3,4-difluorophenyl)-N-ethylpyridazin-3-amine
CID 62201604
6-(4-ethylphenyl)-N-methylpyridazin-3-amine
CID 62202685
N'-[6-(3,4-difluorophenyl)pyridazin-3-yl]ethane-1,2-diamine
CID 116970403
6-(5-bromothiophen-2-yl)-N-methylpyridazin-3-amine
CID 62203714
4-(3-bromo-4-fluorophenyl)-6-methylpyrimidine
CID 82487191
N'-[6-(3-bromo-4-methoxyphenyl)pyridazin-3-yl]-N-methylethane-1,2-diamine
CID 116970469
2-bromo-1-fluoro-4-(4-methylphenyl)benzene
CID 115049308
5-(2,6-difluoro-4-pyridinyl)-2-[6-(methylamino)pyridazin-3-yl]phenol
CID 155041705
6-(2-chloro-5-fluoro-4-methylphenyl)-N-methylpyridazin-3-amine
CID 116973165
6-(3,4-difluorophenyl)-4-N-methylpyrimidine-2,4-diamine
CID 90189196

Frequently Asked Questions

What is the IUPAC name of 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine?
The IUPAC name of 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine (CID 62914654) is 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine.
What is the SMILES notation for 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine?
The canonical SMILES for 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine is CNc1ccc(-c2ccc(F)c(Br)c2)nn1.
What is the InChIKey of 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine?
The InChIKey is RUGXKUFBOMPZKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrFN3/c1-14-11-5-4-10(15-16-11)7-2-3-9(13)8(12)6-7/h2-6H,1H3,(H,14,16).
What are the key properties of 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine?
6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine has a molecular weight of 282.12 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine is sourced from PubChem (CID 62914654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).