morpholine;prop-2-enamide

C7H14N2O2 — CID 23282009

IUPACmorpholine;prop-2-enamide
SMILESC1COCCN1.C=CC(N)=O
InChIInChI=1S/C4H9NO.C3H5NO/c1-3-6-4-2-5-1;1-2-3(4)5/h5H,1-4H2;2H,1H2,(H2,4,5)
InChIKeyUYERIVYDSGUOJG-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.74
Rot. Bonds1

About morpholine;prop-2-enamide

morpholine;prop-2-enamide (PubChem CID 23282009) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is morpholine;prop-2-enamide.

Molecular Properties

Compound Namemorpholine;prop-2-enamide
PubChem CID23282009
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Namemorpholine;prop-2-enamide
SMILESC1COCCN1.C=CC(N)=O
InChIInChI=1S/C4H9NO.C3H5NO/c1-3-6-4-2-5-1;1-2-3(4)5/h5H,1-4H2;2H,1H2,(H2,4,5)
InChIKeyUYERIVYDSGUOJG-UHFFFAOYSA-N
XLogP-0.74
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
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 morpholine;prop-2-enamide?
The IUPAC name of morpholine;prop-2-enamide (CID 23282009) is morpholine;prop-2-enamide.
What is the SMILES notation for morpholine;prop-2-enamide?
The canonical SMILES for morpholine;prop-2-enamide is C1COCCN1.C=CC(N)=O.
What is the InChIKey of morpholine;prop-2-enamide?
The InChIKey is UYERIVYDSGUOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C3H5NO/c1-3-6-4-2-5-1;1-2-3(4)5/h5H,1-4H2;2H,1H2,(H2,4,5).
What are the key properties of morpholine;prop-2-enamide?
morpholine;prop-2-enamide has a molecular weight of 158.20 g/mol, XLogP of -0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine;prop-2-enamide is sourced from PubChem (CID 23282009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).