2-ethoxy-N-ethyl-4-methylpent-4-enamide

C10H19NO2 — CID 89093042

IUPAC2-ethoxy-N-ethyl-4-methylpent-4-enamide
SMILESC=C(C)CC(OCC)C(=O)NCC
InChIInChI=1S/C10H19NO2/c1-5-11-10(12)9(13-6-2)7-8(3)4/h9H,3,5-7H2,1-2,4H3,(H,11,12)
InChIKeyFPQPMWMADCQHGW-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.49
Rot. Bonds6

About 2-ethoxy-N-ethyl-4-methylpent-4-enamide

2-ethoxy-N-ethyl-4-methylpent-4-enamide (PubChem CID 89093042) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-4-methylpent-4-enamide.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-4-methylpent-4-enamide
PubChem CID89093042
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-ethoxy-N-ethyl-4-methylpent-4-enamide
SMILESC=C(C)CC(OCC)C(=O)NCC
InChIInChI=1S/C10H19NO2/c1-5-11-10(12)9(13-6-2)7-8(3)4/h9H,3,5-7H2,1-2,4H3,(H,11,12)
InChIKeyFPQPMWMADCQHGW-UHFFFAOYSA-N
XLogP1.49
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-4-methylpent-4-enamide?
The IUPAC name of 2-ethoxy-N-ethyl-4-methylpent-4-enamide (CID 89093042) is 2-ethoxy-N-ethyl-4-methylpent-4-enamide.
What is the SMILES notation for 2-ethoxy-N-ethyl-4-methylpent-4-enamide?
The canonical SMILES for 2-ethoxy-N-ethyl-4-methylpent-4-enamide is C=C(C)CC(OCC)C(=O)NCC.
What is the InChIKey of 2-ethoxy-N-ethyl-4-methylpent-4-enamide?
The InChIKey is FPQPMWMADCQHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-5-11-10(12)9(13-6-2)7-8(3)4/h9H,3,5-7H2,1-2,4H3,(H,11,12).
What are the key properties of 2-ethoxy-N-ethyl-4-methylpent-4-enamide?
2-ethoxy-N-ethyl-4-methylpent-4-enamide has a molecular weight of 185.27 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-4-methylpent-4-enamide is sourced from PubChem (CID 89093042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).