ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole

C117H206N18O3S3Se3Si — CID 158676411

About ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole

ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole (PubChem CID 158676411) has the molecular formula C117H206N18O3S3Se3Si and a molecular weight of 2274.22 g/mol. Its IUPAC name is ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole.

Molecular Properties

• Compound Name: ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole
• PubChem CID: 158676411
• Molecular Formula: C117H206N18O3S3Se3Si
• Molecular Weight: 2274.22 g/mol
• Exact Mass: 2275.29
• IUPAC Name: ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1=CC=C[Si]1(C)C.Cc1ccc[se]1.Cc1ccccn1.Cc1cccnc1.Cc1ccco1.Cc1cccs1.Cc1ccncc1.Cc1ccncn1.Cc1cnc[se]1.Cc1cncnc1.Cc1cnco1.Cc1cncs1.Cc1ncc[se]1.Cc1ncccn1.Cc1ncco1.Cc1nccs1.Cc1ncncn1
• InChI: InChI=1S/C7H12Si.3C6H7N.3C5H6N2.C5H6O.C5H6S.C5H6Se.C4H5N3.2C4H5NO.2C4H5NS.2C4H5NSe.17C2H6/c1-7-5-4-6-8(7,2)3;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-6-4-7-3-5;1-5-2-3-6-4-7-5;1-5-6-3-2-4-7-5;3*1-5-3-2-4-6-5;1-4-6-2-5-3-7-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;17*1-2/h4-6H,1-3H3;3*2-5H,1H3;3*2-4H,1H3;3*2-4H,1H3;2-3H,1H3;6*2-3H,1H3;17*1-2H3
• InChIKey: IEOOSBBXYYXNAU-UHFFFAOYSA-N
• XLogP: 36.90
• TPSA: 271.44 Ų
• H-Bond Acceptors: 24
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2274.22
LogP ≤ 5	36.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole?

The IUPAC name of ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole (CID 158676411) is ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole.

What is the SMILES notation for ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole?

The canonical SMILES for ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1=CC=C[Si]1(C)C.Cc1ccc[se]1.Cc1ccccn1.Cc1cccnc1.Cc1ccco1.Cc1cccs1.Cc1ccncc1.Cc1ccncn1.Cc1cnc[se]1.Cc1cncnc1.Cc1cnco1.Cc1cncs1.Cc1ncc[se]1.Cc1ncccn1.Cc1ncco1.Cc1nccs1.Cc1ncncn1.

What is the InChIKey of ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole?

The InChIKey is IEOOSBBXYYXNAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12Si.3C6H7N.3C5H6N2.C5H6O.C5H6S.C5H6Se.C4H5N3.2C4H5NO.2C4H5NS.2C4H5NSe.17C2H6/c1-7-5-4-6-8(7,2)3;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-6-4-7-3-5;1-5-2-3-6-4-7-5;1-5-6-3-2-4-7-5;3*1-5-3-2-4-6-5;1-4-6-2-5-3-7-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;17*1-2/h4-6H,1-3H3;3*2-5H,1H3;3*2-4H,1H3;3*2-4H,1H3;2-3H,1H3;6*2-3H,1H3;17*1-2H3.

What are the key properties of ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole?

ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole has a molecular weight of 2274.22 g/mol, XLogP of 36.90, 0 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;2-methylfuran;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-1,3-selenazole;5-methyl-1,3-selenazole;2-methylselenophene;2-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;1,1,2-trimethylsilole is sourced from PubChem (CID 158676411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).