4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine

C9H8BrN3S — CID 117106432

IUPAC4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine
SMILESCc1ccc(-c2cc(Br)c(N)nn2)s1
InChIInChI=1S/C9H8BrN3S/c1-5-2-3-8(14-5)7-4-6(10)9(11)13-12-7/h2-4H,1H3,(H2,11,13)
InChIKeyJCZKLNJOPCWXGH-UHFFFAOYSA-N
MW270.16 g/mol
LogP2.86
Rot. Bonds1

About 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine

4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine (PubChem CID 117106432) has the molecular formula C9H8BrN3S and a molecular weight of 270.16 g/mol. Its IUPAC name is 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine.

Molecular Properties

Compound Name4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine
PubChem CID117106432
Molecular FormulaC9H8BrN3S
Molecular Weight270.16 g/mol
Exact Mass268.96
IUPAC Name4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine
SMILESCc1ccc(-c2cc(Br)c(N)nn2)s1
InChIInChI=1S/C9H8BrN3S/c1-5-2-3-8(14-5)7-4-6(10)9(11)13-12-7/h2-4H,1H3,(H2,11,13)
InChIKeyJCZKLNJOPCWXGH-UHFFFAOYSA-N
XLogP2.86
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-3-(5-methylthiophen-2-yl)-1H-pyridazin-6-one
CID 117106433
ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
CID 91463281
methyl 4-(6-amino-5-bromopyridazin-3-yl)benzoate;methyl 4-(6-aminopyridazin-3-yl)benzoate
CID 158639348
[4-bromo-5-(5-methylthiophen-2-yl)thiophen-2-yl]-trimethylsilane
CID 159208132
4-(3-bromophenyl)-5-(5-methylthiophen-2-yl)-1H-pyrazol-3-amine
CID 43561020
3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine
CID 102753544
4-iodo-5-(5-methylthiophen-2-yl)-1H-pyrazol-3-amine
CID 4556095
2,5-bis(5-methylthiophen-2-yl)thieno[3,2-b]thiophene
CID 71014682
6-(5-methylthiophen-2-yl)-2-phenylpyrimidin-4-amine
CID 112559736
2-[5-amino-3-(5-methylthiophen-2-yl)-6-oxopyridazin-1-yl]acetamide
CID 51586148
2-bromo-5-(5-methylthiophen-2-yl)-1,3-oxazole
CID 117259565
2-(5-methylthiophen-2-yl)aniline
CID 13413493

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine?
The IUPAC name of 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine (CID 117106432) is 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine.
What is the SMILES notation for 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine?
The canonical SMILES for 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine is Cc1ccc(-c2cc(Br)c(N)nn2)s1.
What is the InChIKey of 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine?
The InChIKey is JCZKLNJOPCWXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN3S/c1-5-2-3-8(14-5)7-4-6(10)9(11)13-12-7/h2-4H,1H3,(H2,11,13).
What are the key properties of 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine?
4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine has a molecular weight of 270.16 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(5-methylthiophen-2-yl)pyridazin-3-amine is sourced from PubChem (CID 117106432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).