N-ethyl-2-methoxyprop-2-enamide

C6H11NO2 — CID 102143433

IUPACN-ethyl-2-methoxyprop-2-enamide
SMILESC=C(OC)C(=O)NCC
InChIInChI=1S/C6H11NO2/c1-4-7-6(8)5(2)9-3/h2,4H2,1,3H3,(H,7,8)
InChIKeyJISQSWWBEBXDQG-UHFFFAOYSA-N
MW129.16 g/mol
LogP0.28
Rot. Bonds3

About N-ethyl-2-methoxyprop-2-enamide

N-ethyl-2-methoxyprop-2-enamide (PubChem CID 102143433) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-ethyl-2-methoxyprop-2-enamide.

Molecular Properties

Compound NameN-ethyl-2-methoxyprop-2-enamide
PubChem CID102143433
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-ethyl-2-methoxyprop-2-enamide
SMILESC=C(OC)C(=O)NCC
InChIInChI=1S/C6H11NO2/c1-4-7-6(8)5(2)9-3/h2,4H2,1,3H3,(H,7,8)
InChIKeyJISQSWWBEBXDQG-UHFFFAOYSA-N
XLogP0.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxyprop-2-enamide?
The IUPAC name of N-ethyl-2-methoxyprop-2-enamide (CID 102143433) is N-ethyl-2-methoxyprop-2-enamide.
What is the SMILES notation for N-ethyl-2-methoxyprop-2-enamide?
The canonical SMILES for N-ethyl-2-methoxyprop-2-enamide is C=C(OC)C(=O)NCC.
What is the InChIKey of N-ethyl-2-methoxyprop-2-enamide?
The InChIKey is JISQSWWBEBXDQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-4-7-6(8)5(2)9-3/h2,4H2,1,3H3,(H,7,8).
What are the key properties of N-ethyl-2-methoxyprop-2-enamide?
N-ethyl-2-methoxyprop-2-enamide has a molecular weight of 129.16 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxyprop-2-enamide is sourced from PubChem (CID 102143433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).