(2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone

C₁₀H₁₄N₂OS — CID 23311721

About (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone

(2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone (PubChem CID 23311721) has the molecular formula C₁₀H₁₄N₂OS and a molecular weight of 210.30 g/mol. Its IUPAC name is (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone.

Molecular Properties

• Compound Name: (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
• PubChem CID: 23311721
• Molecular Formula: C₁₀H₁₄N₂OS
• Molecular Weight: 210.30 g/mol
• Exact Mass: 210.08
• IUPAC Name: (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
• SMILES: Cc1ncc(C(=O)N2CCCCC2)s1
• InChI: InChI=1S/C10H14N2OS/c1-8-11-7-9(14-8)10(13)12-5-3-2-4-6-12/h7H,2-6H2,1H3
• InChIKey: IRFRRVLOZGAFMP-UHFFFAOYSA-N
• XLogP: 2.08
• TPSA: 33.20 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 1
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	210.30
LogP ≤ 5	2.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?

The IUPAC name of (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone (CID 23311721) is (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone.

What is the SMILES notation for (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?

The canonical SMILES for (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone is Cc1ncc(C(=O)N2CCCCC2)s1.

What is the InChIKey of (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?

The InChIKey is IRFRRVLOZGAFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-8-11-7-9(14-8)10(13)12-5-3-2-4-6-12/h7H,2-6H2,1H3.

What are the key properties of (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?

(2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone has a molecular weight of 210.30 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for (2-methyl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 23311721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 23311721 — identifiers, structure, computed properties (public domain)

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