2-methyl-4-morpholin-4-ylhex-2-enamide

C11H20N2O2 — CID 70267779

IUPAC2-methyl-4-morpholin-4-ylhex-2-enamide
SMILESCCC(C=C(C)C(N)=O)N1CCOCC1
InChIInChI=1S/C11H20N2O2/c1-3-10(8-9(2)11(12)14)13-4-6-15-7-5-13/h8,10H,3-7H2,1-2H3,(H2,12,14)
InChIKeyZHNBFXXJTWMZJB-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.53
Rot. Bonds4

About 2-methyl-4-morpholin-4-ylhex-2-enamide

2-methyl-4-morpholin-4-ylhex-2-enamide (PubChem CID 70267779) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-methyl-4-morpholin-4-ylhex-2-enamide.

Molecular Properties

Compound Name2-methyl-4-morpholin-4-ylhex-2-enamide
PubChem CID70267779
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name2-methyl-4-morpholin-4-ylhex-2-enamide
SMILESCCC(C=C(C)C(N)=O)N1CCOCC1
InChIInChI=1S/C11H20N2O2/c1-3-10(8-9(2)11(12)14)13-4-6-15-7-5-13/h8,10H,3-7H2,1-2H3,(H2,12,14)
InChIKeyZHNBFXXJTWMZJB-UHFFFAOYSA-N
XLogP0.53
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.53
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-methyl-4-morpholin-4-ylhex-2-enamide?
The IUPAC name of 2-methyl-4-morpholin-4-ylhex-2-enamide (CID 70267779) is 2-methyl-4-morpholin-4-ylhex-2-enamide.
What is the SMILES notation for 2-methyl-4-morpholin-4-ylhex-2-enamide?
The canonical SMILES for 2-methyl-4-morpholin-4-ylhex-2-enamide is CCC(C=C(C)C(N)=O)N1CCOCC1.
What is the InChIKey of 2-methyl-4-morpholin-4-ylhex-2-enamide?
The InChIKey is ZHNBFXXJTWMZJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-10(8-9(2)11(12)14)13-4-6-15-7-5-13/h8,10H,3-7H2,1-2H3,(H2,12,14).
What are the key properties of 2-methyl-4-morpholin-4-ylhex-2-enamide?
2-methyl-4-morpholin-4-ylhex-2-enamide has a molecular weight of 212.29 g/mol, XLogP of 0.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-morpholin-4-ylhex-2-enamide is sourced from PubChem (CID 70267779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).