2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide

C10H20N2O2 — CID 94066300

IUPAC2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide
SMILESCCNC(=O)CN1C[C@@H](C)OC[C@@H]1C
InChIInChI=1S/C10H20N2O2/c1-4-11-10(13)6-12-5-9(3)14-7-8(12)2/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-,9+/m0/s1
InChIKeyYXUGPUQOOJOCPJ-DTWKUNHWSA-N
MW200.28 g/mol
LogP0.23
Rot. Bonds3

About 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide

2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide (PubChem CID 94066300) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide.

Molecular Properties

Compound Name2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide
PubChem CID94066300
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide
SMILESCCNC(=O)CN1C[C@@H](C)OC[C@@H]1C
InChIInChI=1S/C10H20N2O2/c1-4-11-10(13)6-12-5-9(3)14-7-8(12)2/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-,9+/m0/s1
InChIKeyYXUGPUQOOJOCPJ-DTWKUNHWSA-N
XLogP0.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(morpholin-4-yl)propyl]ethanediamide
CID 3128224
N-(2-methylpropyl)-N'-[3-(morpholin-4-yl)propyl]ethanediamide
CID 3127683
N-(propan-2-yl)-N'-[3-(propan-2-yloxy)propyl]ethanediamide
CID 2291413
N-methyl-N'-[3-(morpholin-4-yl)propyl]ethanediamide
CID 3126762
2-Amino-1-(morpholin-4-yl)butan-1-one
CID 22273198
(6R)-1-butyl-6-(1-hydroxyethyl)piperazine-2,3-dione
CID 16745891
N-(2-Methoxy-ethyl)-N'-(2-morpholin-4-yl-ethyl)-oxalamide
CID 3156917
N-[3-(morpholin-4-yl)propyl]-N'-(propan-2-yl)ethanediamide
CID 2055735
2-[Methyl(morpholin-2-ylmethyl)amino]acetamide
CID 64533243
N-(2-Methoxyethyl)-1-piperazineacetamide
CID 7131115
2-Amino-1-(morpholin-4-yl)propan-1-one hydrochloride
CID 22722814
(2S)-2-amino-1-(morpholin-4-yl)butan-1-one hydrochloride
CID 86690681

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide?
The IUPAC name of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide (CID 94066300) is 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide.
What is the SMILES notation for 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide?
The canonical SMILES for 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide is CCNC(=O)CN1C[C@@H](C)OC[C@@H]1C.
What is the InChIKey of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide?
The InChIKey is YXUGPUQOOJOCPJ-DTWKUNHWSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-4-11-10(13)6-12-5-9(3)14-7-8(12)2/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-,9+/m0/s1.
What are the key properties of 2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide?
2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-N-ethylacetamide has a molecular weight of 200.28 g/mol, XLogP of 0.23, 3 rotatable bonds, 1 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-ethylacetamide is sourced from PubChem (CID 94066300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).