(E)-2-methyl-4-morpholin-4-ylpent-2-enamide

C10H18N2O2 — CID 23504386

IUPAC(E)-2-methyl-4-morpholin-4-ylpent-2-enamide
SMILESC/C(=C\C(C)N1CCOCC1)C(N)=O
InChIInChI=1S/C10H18N2O2/c1-8(10(11)13)7-9(2)12-3-5-14-6-4-12/h7,9H,3-6H2,1-2H3,(H2,11,13)/b8-7+
InChIKeyRPTMFQZCSQHDHI-BQYQJAHWSA-N
MW198.27 g/mol
LogP0.14
Rot. Bonds3

About (E)-2-methyl-4-morpholin-4-ylpent-2-enamide

(E)-2-methyl-4-morpholin-4-ylpent-2-enamide (PubChem CID 23504386) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is (E)-2-methyl-4-morpholin-4-ylpent-2-enamide.

Molecular Properties

Compound Name(E)-2-methyl-4-morpholin-4-ylpent-2-enamide
PubChem CID23504386
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name(E)-2-methyl-4-morpholin-4-ylpent-2-enamide
SMILESC/C(=C\C(C)N1CCOCC1)C(N)=O
InChIInChI=1S/C10H18N2O2/c1-8(10(11)13)7-9(2)12-3-5-14-6-4-12/h7,9H,3-6H2,1-2H3,(H2,11,13)/b8-7+
InChIKeyRPTMFQZCSQHDHI-BQYQJAHWSA-N
XLogP0.14
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.14
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 (E)-2-methyl-4-morpholin-4-ylpent-2-enamide?
The IUPAC name of (E)-2-methyl-4-morpholin-4-ylpent-2-enamide (CID 23504386) is (E)-2-methyl-4-morpholin-4-ylpent-2-enamide.
What is the SMILES notation for (E)-2-methyl-4-morpholin-4-ylpent-2-enamide?
The canonical SMILES for (E)-2-methyl-4-morpholin-4-ylpent-2-enamide is C/C(=C\C(C)N1CCOCC1)C(N)=O.
What is the InChIKey of (E)-2-methyl-4-morpholin-4-ylpent-2-enamide?
The InChIKey is RPTMFQZCSQHDHI-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-8(10(11)13)7-9(2)12-3-5-14-6-4-12/h7,9H,3-6H2,1-2H3,(H2,11,13)/b8-7+.
What are the key properties of (E)-2-methyl-4-morpholin-4-ylpent-2-enamide?
(E)-2-methyl-4-morpholin-4-ylpent-2-enamide has a molecular weight of 198.27 g/mol, XLogP of 0.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methyl-4-morpholin-4-ylpent-2-enamide is sourced from PubChem (CID 23504386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).