[1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol

C₉H₁₄N₂OS — CID 131133777

About [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol

[1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol (PubChem CID 131133777) has the molecular formula C₉H₁₄N₂OS and a molecular weight of 198.29 g/mol. Its IUPAC name is [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol.

Molecular Properties

• Compound Name: [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol
• PubChem CID: 131133777
• Molecular Formula: C₉H₁₄N₂OS
• Molecular Weight: 198.29 g/mol
• Exact Mass: 198.08
• IUPAC Name: [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol
• SMILES: Cc1cnc(NCC2(CO)CC2)s1
• InChI: InChI=1S/C9H14N2OS/c1-7-4-10-8(13-7)11-5-9(6-12)2-3-9/h4,12H,2-3,5-6H2,1H3,(H,10,11)
• InChIKey: HRBDOEYNKPPEDU-UHFFFAOYSA-N
• XLogP: 1.64
• TPSA: 45.15 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 13
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	198.29
LogP ≤ 5	1.64
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol?

The IUPAC name of [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol (CID 131133777) is [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol.

What is the SMILES notation for [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol?

The canonical SMILES for [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol is Cc1cnc(NCC2(CO)CC2)s1.

What is the InChIKey of [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol?

The InChIKey is HRBDOEYNKPPEDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-7-4-10-8(13-7)11-5-9(6-12)2-3-9/h4,12H,2-3,5-6H2,1H3,(H,10,11).

What are the key properties of [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol?

[1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol has a molecular weight of 198.29 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 131133777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 131133777 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.