2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid

C8H14N2O5 — CID 66167386

IUPAC2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid
SMILESO=C(O)C(O)CNC(=O)C1COCCN1
InChIInChI=1S/C8H14N2O5/c11-6(8(13)14)3-10-7(12)5-4-15-2-1-9-5/h5-6,9,11H,1-4H2,(H,10,12)(H,13,14)
InChIKeyLQZMILSSPCYFIF-UHFFFAOYSA-N
MW218.21 g/mol
LogP-2.46
Rot. Bonds4

About 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid

2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid (PubChem CID 66167386) has the molecular formula C8H14N2O5 and a molecular weight of 218.21 g/mol. Its IUPAC name is 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid.

Molecular Properties

Compound Name2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid
PubChem CID66167386
Molecular FormulaC8H14N2O5
Molecular Weight218.21 g/mol
Exact Mass218.09
IUPAC Name2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid
SMILESO=C(O)C(O)CNC(=O)C1COCCN1
InChIInChI=1S/C8H14N2O5/c11-6(8(13)14)3-10-7(12)5-4-15-2-1-9-5/h5-6,9,11H,1-4H2,(H,10,12)(H,13,14)
InChIKeyLQZMILSSPCYFIF-UHFFFAOYSA-N
XLogP-2.46
TPSA107.89 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 5-2.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
(3R)-N-[(2R)-2-methylsulfanylpropyl]morpholine-3-carboxamide
CID 99596683
N-(2-hydroxy-3-methylpentyl)morpholine-3-carboxamide;hydrochloride
CID 119784019
(2R)-3-hydroxy-2-(morpholine-3-carbonylamino)propanoic acid
CID 80750560
(3R)-N-(2-aminoethyl)morpholine-3-carboxamide;hydrochloride
CID 130616444
N-(2-phenylsulfanylpropyl)morpholine-3-carboxamide;hydrochloride
CID 119804403
(3R)-N-[(2S)-2,3-diphenylpropyl]morpholine-3-carboxamide
CID 124699410
(3R)-N-[(2R)-2-(2-fluorophenyl)-2-hydroxyethyl]morpholine-3-carboxamide
CID 124588211
N-(2-chloroprop-2-enyl)morpholine-3-carboxamide
CID 115739704
1-[(morpholine-3-carbonylamino)methyl]cyclobutane-1-carboxylic acid
CID 113311232
N-(2-phenyl-2-pyrrolidin-1-ylethyl)morpholine-3-carboxamide;dihydrochloride
CID 119831374
(3S)-N-(2-methoxyethyl)morpholine-3-carboxamide
CID 96998631

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid?
The IUPAC name of 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid (CID 66167386) is 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid.
What is the SMILES notation for 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid?
The canonical SMILES for 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid is O=C(O)C(O)CNC(=O)C1COCCN1.
What is the InChIKey of 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid?
The InChIKey is LQZMILSSPCYFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O5/c11-6(8(13)14)3-10-7(12)5-4-15-2-1-9-5/h5-6,9,11H,1-4H2,(H,10,12)(H,13,14).
What are the key properties of 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid?
2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid has a molecular weight of 218.21 g/mol, XLogP of -2.46, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid is sourced from PubChem (CID 66167386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).