2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide

C12H14N6O2S — CID 115280614

IUPAC2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1cc(N)nc(SCC(=O)Nc2nnc(C3CC3)o2)n1
InChIInChI=1S/C12H14N6O2S/c1-6-4-8(13)15-12(14-6)21-5-9(19)16-11-18-17-10(20-11)7-2-3-7/h4,7H,2-3,5H2,1H3,(H2,13,14,15)(H,16,18,19)
InChIKeyLERFDJDXECJITJ-UHFFFAOYSA-N
MW306.35 g/mol
LogP1.36
Rot. Bonds5

About 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide

2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 115280614) has the molecular formula C12H14N6O2S and a molecular weight of 306.35 g/mol. Its IUPAC name is 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID115280614
Molecular FormulaC12H14N6O2S
Molecular Weight306.35 g/mol
Exact Mass306.09
IUPAC Name2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1cc(N)nc(SCC(=O)Nc2nnc(C3CC3)o2)n1
InChIInChI=1S/C12H14N6O2S/c1-6-4-8(13)15-12(14-6)21-5-9(19)16-11-18-17-10(20-11)7-2-3-7/h4,7H,2-3,5H2,1H3,(H2,13,14,15)(H,16,18,19)
InChIKeyLERFDJDXECJITJ-UHFFFAOYSA-N
XLogP1.36
TPSA119.82 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.35
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(2-fluorophenyl)acetamide
CID 40663166
2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]acetamide
CID 4113951
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(4-bromophenyl)acetamide
CID 17450187
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-tert-butylacetamide
CID 47110965
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]acetamide
CID 34945503
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 39067806
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(1-ethylpiperidin-4-yl)acetamide
CID 18130863
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(4-butan-2-ylphenyl)acetamide
CID 78801247
S-[2-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl] ethanethioate
CID 16949277
2-(cyclopropylamino)-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide
CID 61253878
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-methoxyacetamide
CID 64591903
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(2-ethylphenyl)acetamide
CID 40663485

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide (CID 115280614) is 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide is Cc1cc(N)nc(SCC(=O)Nc2nnc(C3CC3)o2)n1.
What is the InChIKey of 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is LERFDJDXECJITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O2S/c1-6-4-8(13)15-12(14-6)21-5-9(19)16-11-18-17-10(20-11)7-2-3-7/h4,7H,2-3,5H2,1H3,(H2,13,14,15)(H,16,18,19).
What are the key properties of 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide?
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 306.35 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 115280614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).