(E)-N-(2-methoxyethyl)pent-2-enamide

C8H15NO2 — CID 127125380

IUPAC(E)-N-(2-methoxyethyl)pent-2-enamide
SMILESCC/C=C/C(=O)NCCOC
InChIInChI=1S/C8H15NO2/c1-3-4-5-8(10)9-6-7-11-2/h4-5H,3,6-7H2,1-2H3,(H,9,10)/b5-4+
InChIKeyKWIIVFQOOIRRRS-SNAWJCMRSA-N
MW157.21 g/mol
LogP0.72
Rot. Bonds5

About (E)-N-(2-methoxyethyl)pent-2-enamide

(E)-N-(2-methoxyethyl)pent-2-enamide (PubChem CID 127125380) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is (E)-N-(2-methoxyethyl)pent-2-enamide.

Molecular Properties

Compound Name(E)-N-(2-methoxyethyl)pent-2-enamide
PubChem CID127125380
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name(E)-N-(2-methoxyethyl)pent-2-enamide
SMILESCC/C=C/C(=O)NCCOC
InChIInChI=1S/C8H15NO2/c1-3-4-5-8(10)9-6-7-11-2/h4-5H,3,6-7H2,1-2H3,(H,9,10)/b5-4+
InChIKeyKWIIVFQOOIRRRS-SNAWJCMRSA-N
XLogP0.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-N-(2-methoxyethyl)pent-2-enamide?
The IUPAC name of (E)-N-(2-methoxyethyl)pent-2-enamide (CID 127125380) is (E)-N-(2-methoxyethyl)pent-2-enamide.
What is the SMILES notation for (E)-N-(2-methoxyethyl)pent-2-enamide?
The canonical SMILES for (E)-N-(2-methoxyethyl)pent-2-enamide is CC/C=C/C(=O)NCCOC.
What is the InChIKey of (E)-N-(2-methoxyethyl)pent-2-enamide?
The InChIKey is KWIIVFQOOIRRRS-SNAWJCMRSA-N. The full InChI is InChI=1S/C8H15NO2/c1-3-4-5-8(10)9-6-7-11-2/h4-5H,3,6-7H2,1-2H3,(H,9,10)/b5-4+.
What are the key properties of (E)-N-(2-methoxyethyl)pent-2-enamide?
(E)-N-(2-methoxyethyl)pent-2-enamide has a molecular weight of 157.21 g/mol, XLogP of 0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2-methoxyethyl)pent-2-enamide is sourced from PubChem (CID 127125380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).