2-morpholin-4-ylpent-2-enamide

C9H16N2O2 — CID 68839562

IUPAC2-morpholin-4-ylpent-2-enamide
SMILESCCC=C(C(N)=O)N1CCOCC1
InChIInChI=1S/C9H16N2O2/c1-2-3-8(9(10)12)11-4-6-13-7-5-11/h3H,2,4-7H2,1H3,(H2,10,12)
InChIKeyHJKZKMHXOXECGY-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.10
Rot. Bonds3

About 2-morpholin-4-ylpent-2-enamide

2-morpholin-4-ylpent-2-enamide (PubChem CID 68839562) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2-morpholin-4-ylpent-2-enamide.

Molecular Properties

Compound Name2-morpholin-4-ylpent-2-enamide
PubChem CID68839562
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name2-morpholin-4-ylpent-2-enamide
SMILESCCC=C(C(N)=O)N1CCOCC1
InChIInChI=1S/C9H16N2O2/c1-2-3-8(9(10)12)11-4-6-13-7-5-11/h3H,2,4-7H2,1H3,(H2,10,12)
InChIKeyHJKZKMHXOXECGY-UHFFFAOYSA-N
XLogP0.10
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylpent-2-enamide?
The IUPAC name of 2-morpholin-4-ylpent-2-enamide (CID 68839562) is 2-morpholin-4-ylpent-2-enamide.
What is the SMILES notation for 2-morpholin-4-ylpent-2-enamide?
The canonical SMILES for 2-morpholin-4-ylpent-2-enamide is CCC=C(C(N)=O)N1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylpent-2-enamide?
The InChIKey is HJKZKMHXOXECGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-2-3-8(9(10)12)11-4-6-13-7-5-11/h3H,2,4-7H2,1H3,(H2,10,12).
What are the key properties of 2-morpholin-4-ylpent-2-enamide?
2-morpholin-4-ylpent-2-enamide has a molecular weight of 184.24 g/mol, XLogP of 0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylpent-2-enamide is sourced from PubChem (CID 68839562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).