N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine

C8H9N5OS — CID 80891678

IUPACN-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine
SMILESCNc1cncc(Sc2nnc(C)o2)n1
InChIInChI=1S/C8H9N5OS/c1-5-12-13-8(14-5)15-7-4-10-3-6(9-2)11-7/h3-4H,1-2H3,(H,9,11)
InChIKeyHVVZPQIFFAGGNA-UHFFFAOYSA-N
MW223.26 g/mol
LogP1.36
Rot. Bonds3

About N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine

N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine (PubChem CID 80891678) has the molecular formula C8H9N5OS and a molecular weight of 223.26 g/mol. Its IUPAC name is N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine
PubChem CID80891678
Molecular FormulaC8H9N5OS
Molecular Weight223.26 g/mol
Exact Mass223.05
IUPAC NameN-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine
SMILESCNc1cncc(Sc2nnc(C)o2)n1
InChIInChI=1S/C8H9N5OS/c1-5-12-13-8(14-5)15-7-4-10-3-6(9-2)11-7/h3-4H,1-2H3,(H,9,11)
InChIKeyHVVZPQIFFAGGNA-UHFFFAOYSA-N
XLogP1.36
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

methyl 6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazine-2-carboxylate
CID 66451373
2-[(3-chloro-1,2,4-triazin-5-yl)sulfanyl]-5-methyl-1,3,4-oxadiazole
CID 115000855
N-methyl-6-(5-methylpyrimidin-2-yl)sulfanylpyrazin-2-amine
CID 80892411
N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-2-phenylpyrimidin-4-amine
CID 115916036
2-(2-chloropyrimidin-4-yl)sulfanyl-5-methyl-1,3,4-oxadiazole
CID 62343482
6-[(5-chloro-2-pyridinyl)sulfanyl]-N-methylpyrazin-2-amine
CID 80891522
N-methyl-6-(3-methylbutan-2-ylsulfanyl)pyrazin-2-amine
CID 107765491
2-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-propylpyrimidin-4-amine
CID 80891676
N,5-dimethyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrimidin-4-amine
CID 80892356
N-ethyl-6-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrazin-2-amine
CID 106928438
6-(3-methoxyphenyl)sulfanyl-N-methylpyrazin-2-amine
CID 80884185
N,6-dimethyl-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]pyrimidin-4-amine
CID 80654482

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine?
The IUPAC name of N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine (CID 80891678) is N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine is CNc1cncc(Sc2nnc(C)o2)n1.
What is the InChIKey of N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine?
The InChIKey is HVVZPQIFFAGGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5OS/c1-5-12-13-8(14-5)15-7-4-10-3-6(9-2)11-7/h3-4H,1-2H3,(H,9,11).
What are the key properties of N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine?
N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine has a molecular weight of 223.26 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyrazin-2-amine is sourced from PubChem (CID 80891678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).