(2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid

C10H17NO4 — CID 59930843

IUPAC(2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid
SMILESCC[C@H](CC(=O)N1CCOCC1)C(=O)O
InChIInChI=1S/C10H17NO4/c1-2-8(10(13)14)7-9(12)11-3-5-15-6-4-11/h8H,2-7H2,1H3,(H,13,14)/t8-/m1/s1
InChIKeyMUEVTVLIGLYQJP-MRVPVSSYSA-N
MW215.25 g/mol
LogP0.35
Rot. Bonds4

About (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid

(2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid (PubChem CID 59930843) has the molecular formula C10H17NO4 and a molecular weight of 215.25 g/mol. Its IUPAC name is (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid.

Molecular Properties

Compound Name(2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid
PubChem CID59930843
Molecular FormulaC10H17NO4
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Name(2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid
SMILESCC[C@H](CC(=O)N1CCOCC1)C(=O)O
InChIInChI=1S/C10H17NO4/c1-2-8(10(13)14)7-9(12)11-3-5-15-6-4-11/h8H,2-7H2,1H3,(H,13,14)/t8-/m1/s1
InChIKeyMUEVTVLIGLYQJP-MRVPVSSYSA-N
XLogP0.35
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-4-methyl-2-(2-morpholin-4-yl-2-oxoethyl)pentanoic acid
CID 54200282
2-(2-methylpropylsulfonylmethyl)-4-morpholin-4-yl-4-oxobutanoic acid
CID 11565984
2-ethylbutanoic acid;2-ethyl-1-morpholin-4-ylbutan-1-one;morpholine
CID 160748573
formaldehyde;3-methyl-1-morpholin-4-ylbutan-1-one
CID 143869951
(2S)-N-(4-chlorophenyl)-2-ethyl-N-hydroxy-4-morpholin-4-yl-4-oxobutanamide
CID 90779123
2-(2-morpholin-4-yl-2-oxoethyl)sulfonylpropanoic acid
CID 43186071
4-(diethylamino)-3-methyl-1-morpholin-4-ylbutan-1-one
CID 166717166
2-methyl-4-morpholin-4-yl-4-oxobutanenitrile
CID 82111559
4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one
CID 166717167
2-[(1-benzylcyclopropyl)methyl]-4-morpholin-4-yl-4-oxobutanoic acid
CID 21025676
2-isocyano-1-morpholin-4-ylbutan-1-one
CID 134865549
4-morpholin-4-yl-4-oxo-2-phenylbutanoic acid
CID 82133442

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid?
The IUPAC name of (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid (CID 59930843) is (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid.
What is the SMILES notation for (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid?
The canonical SMILES for (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid is CC[C@H](CC(=O)N1CCOCC1)C(=O)O.
What is the InChIKey of (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid?
The InChIKey is MUEVTVLIGLYQJP-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H17NO4/c1-2-8(10(13)14)7-9(12)11-3-5-15-6-4-11/h8H,2-7H2,1H3,(H,13,14)/t8-/m1/s1.
What are the key properties of (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid?
(2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid has a molecular weight of 215.25 g/mol, XLogP of 0.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-4-morpholin-4-yl-4-oxobutanoic acid is sourced from PubChem (CID 59930843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).