5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine

C9H8BrN3OS — CID 106921576

IUPAC5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine
SMILESCc1coc(Sc2ncc(Br)cc2N)n1
InChIInChI=1S/C9H8BrN3OS/c1-5-4-14-9(13-5)15-8-7(11)2-6(10)3-12-8/h2-4H,11H2,1H3
InChIKeyRXMDJSDOISUFIW-UHFFFAOYSA-N
MW286.15 g/mol
LogP2.87
Rot. Bonds2

About 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine

5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine (PubChem CID 106921576) has the molecular formula C9H8BrN3OS and a molecular weight of 286.15 g/mol. Its IUPAC name is 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine
PubChem CID106921576
Molecular FormulaC9H8BrN3OS
Molecular Weight286.15 g/mol
Exact Mass284.96
IUPAC Name5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine
SMILESCc1coc(Sc2ncc(Br)cc2N)n1
InChIInChI=1S/C9H8BrN3OS/c1-5-4-14-9(13-5)15-8-7(11)2-6(10)3-12-8/h2-4H,11H2,1H3
InChIKeyRXMDJSDOISUFIW-UHFFFAOYSA-N
XLogP2.87
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.15
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrimidin-2-amine
CID 106928532
[3-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrazin-2-yl]methanamine
CID 106923706
4-bromo-5-fluoro-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]aniline
CID 106921569
2,5-dimethyl-6-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrimidin-4-amine
CID 106928551
3-bromo-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]aniline
CID 106921558
5-bromo-2-phenylsulfanylpyridin-3-amine
CID 61228876
5-bromo-2-naphthalen-2-ylsulfanylpyridin-3-amine
CID 55224154
3-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrazine-2-carboxylic acid
CID 106926061
5-bromo-2-methyl-3-(4-methyl-1,3-oxazol-2-yl)aniline
CID 107874095
6-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]-2-propan-2-ylpyrimidin-4-amine
CID 106928531
2-[(4-bromo-1,3-thiazol-2-yl)sulfanyl]-4-methyl-1,3-oxazole
CID 106923485
5-bromo-N-ethyl-6-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrimidin-4-amine
CID 114073937

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine?
The IUPAC name of 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine (CID 106921576) is 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine.
What is the SMILES notation for 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine?
The canonical SMILES for 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine is Cc1coc(Sc2ncc(Br)cc2N)n1.
What is the InChIKey of 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine?
The InChIKey is RXMDJSDOISUFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN3OS/c1-5-4-14-9(13-5)15-8-7(11)2-6(10)3-12-8/h2-4H,11H2,1H3.
What are the key properties of 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine?
5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine has a molecular weight of 286.15 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyridin-3-amine is sourced from PubChem (CID 106921576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).