2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide

C8H14N2O5 — CID 68766850

IUPAC2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide
SMILESNC(=O)C(O)C(O)C(=O)N1CCOCC1
InChIInChI=1S/C8H14N2O5/c9-7(13)5(11)6(12)8(14)10-1-3-15-4-2-10/h5-6,11-12H,1-4H2,(H2,9,13)
InChIKeyZJXYFBNFGQMXQV-UHFFFAOYSA-N
MW218.21 g/mol
LogP-2.95
Rot. Bonds3

About 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide

2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide (PubChem CID 68766850) has the molecular formula C8H14N2O5 and a molecular weight of 218.21 g/mol. Its IUPAC name is 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide.

Molecular Properties

Compound Name2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide
PubChem CID68766850
Molecular FormulaC8H14N2O5
Molecular Weight218.21 g/mol
Exact Mass218.09
IUPAC Name2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide
SMILESNC(=O)C(O)C(O)C(=O)N1CCOCC1
InChIInChI=1S/C8H14N2O5/c9-7(13)5(11)6(12)8(14)10-1-3-15-4-2-10/h5-6,11-12H,1-4H2,(H2,9,13)
InChIKeyZJXYFBNFGQMXQV-UHFFFAOYSA-N
XLogP-2.95
TPSA113.09 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 5-2.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-hydroxy-3-methyl-1-morpholin-4-ylbutan-1-one
CID 69460030
2-hydroxy-3-morpholin-4-yl-3-oxopropanoic acid
CID 140976949
(2R)-2-amino-1-morpholin-4-ylpropan-1-one;hydrochloride
CID 156637014
(2R)-2-amino-1-(1,4,7-trioxa-10-azacyclododec-10-yl)propan-1-one
CID 1121708
(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one
CID 69457105
2-amino-3-methyl-1-morpholin-4-ylbutan-1-one
CID 22492154
(3S)-3-amino-4-cyclohexyl-2-hydroxy-1-morpholin-4-ylbutan-1-one
CID 86741929
(2S)-2-chloro-1-morpholin-4-ylpropan-1-one
CID 2434799
2,5-diisocyano-1,6-dimorpholin-4-ylhexane-1,6-dione
CID 101234827
2-isocyano-1-morpholin-4-ylbutan-1-one
CID 134865549
2-amino-2-cyclopentyl-1-morpholin-4-ylethanone
CID 54288734
2,3-dimethyl-4-morpholin-4-yl-4-oxobutanoic acid
CID 21025679

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide?
The IUPAC name of 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide (CID 68766850) is 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide.
What is the SMILES notation for 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide?
The canonical SMILES for 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide is NC(=O)C(O)C(O)C(=O)N1CCOCC1.
What is the InChIKey of 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide?
The InChIKey is ZJXYFBNFGQMXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O5/c9-7(13)5(11)6(12)8(14)10-1-3-15-4-2-10/h5-6,11-12H,1-4H2,(H2,9,13).
What are the key properties of 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide?
2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide has a molecular weight of 218.21 g/mol, XLogP of -2.95, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxy-4-morpholin-4-yl-4-oxobutanamide is sourced from PubChem (CID 68766850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).