3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate

Name: 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₂₁NO₆ — CID 155928177

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate

SMILESC=C(C)C(=O)OCCCOC(=O)NCCOC(=O)C(=C)C

InChIInChI=1S/C14H21NO6/c1-10(2)12(16)19-7-5-8-21-14(18)15-6-9-20-13(17)11(3)4/h1,3,5-9H2,2,4H3,(H,15,18)

InChIKeyFFLOROHZWLAYMI-UHFFFAOYSA-N

MW299.32 g/mol

LogP1.34

Rot. Bonds9

About 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate

3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate (PubChem CID 155928177) has the molecular formula C₁₄H₂₁NO₆ and a molecular weight of 299.32 g/mol. Its IUPAC name is 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name	3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate
PubChem CID	155928177
Molecular Formula	C₁₄H₂₁NO₆
Molecular Weight	299.32 g/mol
Exact Mass	299.14
IUPAC Name	3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate
SMILES	C=C(C)C(=O)OCCCOC(=O)NCCOC(=O)C(=C)C
InChI	InChI=1S/C14H21NO6/c1-10(2)12(16)19-7-5-8-21-14(18)15-6-9-20-13(17)11(3)4/h1,3,5-9H2,2,4H3,(H,15,18)
InChIKey	FFLOROHZWLAYMI-UHFFFAOYSA-N
XLogP	1.34
TPSA	90.93 Å²
H-Bond Donors	1
H-Bond Acceptors	6
Rotatable Bonds	9
Heavy Atoms	21
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	299.32
LogP ≤ 5	1.34
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

Structural Alerts	{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate?

The IUPAC name of 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate (CID 155928177) is 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate.

What is the SMILES notation for 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate?

The canonical SMILES for 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCCOC(=O)NCCOC(=O)C(=C)C.

What is the InChIKey of 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate?

The InChIKey is FFLOROHZWLAYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO6/c1-10(2)12(16)19-7-5-8-21-14(18)15-6-9-20-13(17)11(3)4/h1,3,5-9H2,2,4H3,(H,15,18).

What are the key properties of 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate?

3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate has a molecular weight of 299.32 g/mol, XLogP of 1.34, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 155928177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 155928177 — identifiers, structure, computed properties (public domain)

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