N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide

C₁₀H₁₇NO₃ — CID 132577956

About N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide

N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide (PubChem CID 132577956) has the molecular formula C₁₀H₁₇NO₃ and a molecular weight of 199.25 g/mol. Its IUPAC name is N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide.

Molecular Properties

• Compound Name: N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide
• PubChem CID: 132577956
• Molecular Formula: C₁₀H₁₇NO₃
• Molecular Weight: 199.25 g/mol
• Exact Mass: 199.12
• IUPAC Name: N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide
• SMILES: C=CCOC(C)OCCNC(=O)C=C
• InChI: InChI=1S/C10H17NO3/c1-4-7-13-9(3)14-8-6-11-10(12)5-2/h4-5,9H,1-2,6-8H2,3H3,(H,11,12)
• InChIKey: OFUVTNFVQYLZIB-UHFFFAOYSA-N
• XLogP: 0.85
• TPSA: 47.56 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 8
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	199.25
LogP ≤ 5	0.85
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide?

The IUPAC name of N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide (CID 132577956) is N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide.

What is the SMILES notation for N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide?

The canonical SMILES for N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide is C=CCOC(C)OCCNC(=O)C=C.

What is the InChIKey of N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide?

The InChIKey is OFUVTNFVQYLZIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-4-7-13-9(3)14-8-6-11-10(12)5-2/h4-5,9H,1-2,6-8H2,3H3,(H,11,12).

What are the key properties of N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide?

N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide has a molecular weight of 199.25 g/mol, XLogP of 0.85, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(1-prop-2-enoxyethoxy)ethyl]prop-2-enamide is sourced from PubChem (CID 132577956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 132577956 — identifiers, structure, computed properties (public domain)

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