N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one

C14H24N2O3 — CID 131732926

IUPACN,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one
SMILESC=CC(=O)N(CC)CC.C=CC(=O)N1CCOCC1
InChIInChI=1S/C7H11NO2.C7H13NO/c1-2-7(9)8-3-5-10-6-4-8;1-4-7(9)8(5-2)6-3/h2H,1,3-6H2;4H,1,5-6H2,2-3H3
InChIKeyFWGJCJFKUYLJTE-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.07
Rot. Bonds4

About N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one

N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one (PubChem CID 131732926) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one.

Molecular Properties

Compound NameN,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one
PubChem CID131732926
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC NameN,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one
SMILESC=CC(=O)N(CC)CC.C=CC(=O)N1CCOCC1
InChIInChI=1S/C7H11NO2.C7H13NO/c1-2-7(9)8-3-5-10-6-4-8;1-4-7(9)8(5-2)6-3/h2H,1,3-6H2;4H,1,5-6H2,2-3H3
InChIKeyFWGJCJFKUYLJTE-UHFFFAOYSA-N
XLogP1.07
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.07
H-Bond Donors ≤ 50
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 N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one?
The IUPAC name of N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one (CID 131732926) is N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one.
What is the SMILES notation for N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one?
The canonical SMILES for N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one is C=CC(=O)N(CC)CC.C=CC(=O)N1CCOCC1.
What is the InChIKey of N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one?
The InChIKey is FWGJCJFKUYLJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2.C7H13NO/c1-2-7(9)8-3-5-10-6-4-8;1-4-7(9)8(5-2)6-3/h2H,1,3-6H2;4H,1,5-6H2,2-3H3.
What are the key properties of N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one?
N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one has a molecular weight of 268.36 g/mol, XLogP of 1.07, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylprop-2-enamide;1-morpholin-4-ylprop-2-en-1-one is sourced from PubChem (CID 131732926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).