2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid

C11H20N2O5 — CID 104645019

IUPAC2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid
SMILESCC(NCC(C)(O)C(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O5/c1-8(12-7-11(2,17)10(15)16)9(14)13-3-5-18-6-4-13/h8,12,17H,3-7H2,1-2H3,(H,15,16)
InChIKeyDORBFDGAGZYENK-UHFFFAOYSA-N
MW260.29 g/mol
LogP-1.34
Rot. Bonds5

About 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid

2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid (PubChem CID 104645019) has the molecular formula C11H20N2O5 and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid.

Molecular Properties

Compound Name2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid
PubChem CID104645019
Molecular FormulaC11H20N2O5
Molecular Weight260.29 g/mol
Exact Mass260.14
IUPAC Name2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid
SMILESCC(NCC(C)(O)C(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O5/c1-8(12-7-11(2,17)10(15)16)9(14)13-3-5-18-6-4-13/h8,12,17H,3-7H2,1-2H3,(H,15,16)
InChIKeyDORBFDGAGZYENK-UHFFFAOYSA-N
XLogP-1.34
TPSA99.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 5-1.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid with MolForge

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Related Compounds

2-[(4-methoxy-2,2-dimethylbutyl)amino]-1-morpholin-4-ylpropan-1-one
CID 104624292
2-hydroxy-2-methyl-3-(morpholine-4-carbonylamino)propanoic acid
CID 66173250
2-[2-(tert-butylamino)ethylamino]-1-morpholin-4-ylpropan-1-one
CID 107446064
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylpropan-1-one
CID 114174239
2-(6-hydroxyhexylamino)-1-morpholin-4-ylpropan-1-one
CID 107703595
3,3,3-trifluoro-2-methyl-2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid
CID 79789681
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
CID 67759315
2-hydroxy-2-methyl-3-(morpholin-4-ylcarbamoylamino)propanoic acid
CID 83020408
2-(3-methylsulfonylpropylamino)-1-morpholin-4-ylpropan-1-one
CID 54905141
2-hydroxy-2-methyl-3-[[2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetyl]amino]propanoic acid
CID 66173764
2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one
CID 113352721
3-chloro-2,2-dimethyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)propanamide
CID 113408370

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid?
The IUPAC name of 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid (CID 104645019) is 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid.
What is the SMILES notation for 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid?
The canonical SMILES for 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid is CC(NCC(C)(O)C(=O)O)C(=O)N1CCOCC1.
What is the InChIKey of 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid?
The InChIKey is DORBFDGAGZYENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O5/c1-8(12-7-11(2,17)10(15)16)9(14)13-3-5-18-6-4-13/h8,12,17H,3-7H2,1-2H3,(H,15,16).
What are the key properties of 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid?
2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid has a molecular weight of 260.29 g/mol, XLogP of -1.34, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid is sourced from PubChem (CID 104645019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).