5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine

C11H11BrN2S — CID 115148473

IUPAC5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine
SMILESCc1cc(Br)cnc1Nc1sccc1C
InChIInChI=1S/C11H11BrN2S/c1-7-3-4-15-11(7)14-10-8(2)5-9(12)6-13-10/h3-6H,1-2H3,(H,13,14)
InChIKeyOYNKWSOQUMYJNB-UHFFFAOYSA-N
MW283.19 g/mol
LogP4.27
Rot. Bonds2

About 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine

5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine (PubChem CID 115148473) has the molecular formula C11H11BrN2S and a molecular weight of 283.19 g/mol. Its IUPAC name is 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine
PubChem CID115148473
Molecular FormulaC11H11BrN2S
Molecular Weight283.19 g/mol
Exact Mass281.98
IUPAC Name5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine
SMILESCc1cc(Br)cnc1Nc1sccc1C
InChIInChI=1S/C11H11BrN2S/c1-7-3-4-15-11(7)14-10-8(2)5-9(12)6-13-10/h3-6H,1-2H3,(H,13,14)
InChIKeyOYNKWSOQUMYJNB-UHFFFAOYSA-N
XLogP4.27
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.19
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-3-methyl-N-[2-methyl-2-(3-methylthiophen-2-yl)propyl]pyridin-2-amine
CID 115148718
5-bromo-3-methyl-N-(2-methylphenyl)pyridin-2-amine
CID 53410205
5-bromo-N-(4-bromo-3-chlorophenyl)-3-methylpyridin-2-amine
CID 107616385
5-bromo-3-methyl-N-[4-(trifluoromethyl)phenyl]pyridin-2-amine
CID 84609052
5-bromo-N-(2-bromo-3-chlorophenyl)-3-methylpyridin-2-amine
CID 103481305
N-(5-bromo-3-methyl-2-pyridinyl)-2-(methylaminomethyl)thiophene-3-sulfonamide
CID 106076794
5-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methylpyridin-2-amine
CID 84604425
5-bromo-N-(4-ethoxy-3-methylphenyl)-3-methylpyridin-2-amine
CID 115148422
5-bromo-N-[2-(1-chloroethyl)phenyl]-3-methylpyridin-2-amine
CID 79718663
5-bromo-3-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyridin-2-amine
CID 79717686
5-bromo-N-(4-methoxy-2,3,5-trimethylphenyl)-3-methylpyridin-2-amine
CID 115148429
5-bromo-3-methyl-N-pyrrol-1-ylpyridin-2-amine
CID 79717901

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine (CID 115148473) is 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine is Cc1cc(Br)cnc1Nc1sccc1C.
What is the InChIKey of 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine?
The InChIKey is OYNKWSOQUMYJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2S/c1-7-3-4-15-11(7)14-10-8(2)5-9(12)6-13-10/h3-6H,1-2H3,(H,13,14).
What are the key properties of 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine?
5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine has a molecular weight of 283.19 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-methyl-N-(3-methylthiophen-2-yl)pyridin-2-amine is sourced from PubChem (CID 115148473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).