N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine

C₁₀H₁₈N₂O₂ — CID 65183024

About N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine

N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine (PubChem CID 65183024) has the molecular formula C₁₀H₁₈N₂O₂ and a molecular weight of 198.27 g/mol. Its IUPAC name is N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine.

Molecular Properties

• Compound Name: N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
• PubChem CID: 65183024
• Molecular Formula: C₁₀H₁₈N₂O₂
• Molecular Weight: 198.27 g/mol
• Exact Mass: 198.14
• IUPAC Name: N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
• SMILES: CCCNC(C)c1ncc(COC)o1
• InChI: InChI=1S/C10H18N2O2/c1-4-5-11-8(2)10-12-6-9(14-10)7-13-3/h6,8,11H,4-5,7H2,1-3H3
• InChIKey: ZVMWHARTPAYLEE-UHFFFAOYSA-N
• XLogP: 1.88
• TPSA: 47.29 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	198.27
LogP ≤ 5	1.88
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?

The IUPAC name of N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine (CID 65183024) is N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine.

What is the SMILES notation for N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?

The canonical SMILES for N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine is CCCNC(C)c1ncc(COC)o1.

What is the InChIKey of N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?

The InChIKey is ZVMWHARTPAYLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-4-5-11-8(2)10-12-6-9(14-10)7-13-3/h6,8,11H,4-5,7H2,1-3H3.

What are the key properties of N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?

N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine has a molecular weight of 198.27 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[5-(methoxymethyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine is sourced from PubChem (CID 65183024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 65183024 — identifiers, structure, computed properties (public domain)

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