2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide

C14H26N2O2 — CID 94066325

IUPAC2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)CN1C[C@@H](C)OC[C@@H]1C
InChIInChI=1S/C14H26N2O2/c1-6-15(7-11(2)3)14(17)9-16-8-13(5)18-10-12(16)4/h12-13H,2,6-10H2,1,3-5H3/t12-,13+/m0/s1
InChIKeyGJQYUCKWVVQIDB-QWHCGFSZSA-N
MW254.37 g/mol
LogP1.52
Rot. Bonds5

About 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide

2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide (PubChem CID 94066325) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide.

Molecular Properties

Compound Name2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
PubChem CID94066325
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)CN1C[C@@H](C)OC[C@@H]1C
InChIInChI=1S/C14H26N2O2/c1-6-15(7-11(2)3)14(17)9-16-8-13(5)18-10-12(16)4/h12-13H,2,6-10H2,1,3-5H3/t12-,13+/m0/s1
InChIKeyGJQYUCKWVVQIDB-QWHCGFSZSA-N
XLogP1.52
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The IUPAC name of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide (CID 94066325) is 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide.
What is the SMILES notation for 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The canonical SMILES for 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide is C=C(C)CN(CC)C(=O)CN1C[C@@H](C)OC[C@@H]1C.
What is the InChIKey of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The InChIKey is GJQYUCKWVVQIDB-QWHCGFSZSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-6-15(7-11(2)3)14(17)9-16-8-13(5)18-10-12(16)4/h12-13H,2,6-10H2,1,3-5H3/t12-,13+/m0/s1.
What are the key properties of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide has a molecular weight of 254.37 g/mol, XLogP of 1.52, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)acetamide is sourced from PubChem (CID 94066325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).