2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid

C11H18N2O6 — CID 113408335

IUPAC2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid
SMILESCC(NC(=O)COCC(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C11H18N2O6/c1-8(11(17)13-2-4-18-5-3-13)12-9(14)6-19-7-10(15)16/h8H,2-7H2,1H3,(H,12,14)(H,15,16)
InChIKeyPNLFJEWMGWZBPT-UHFFFAOYSA-N
MW274.27 g/mol
LogP-1.55
Rot. Bonds6

About 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid

2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid (PubChem CID 113408335) has the molecular formula C11H18N2O6 and a molecular weight of 274.27 g/mol. Its IUPAC name is 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid.

Molecular Properties

Compound Name2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid
PubChem CID113408335
Molecular FormulaC11H18N2O6
Molecular Weight274.27 g/mol
Exact Mass274.12
IUPAC Name2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid
SMILESCC(NC(=O)COCC(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C11H18N2O6/c1-8(11(17)13-2-4-18-5-3-13)12-9(14)6-19-7-10(15)16/h8H,2-7H2,1H3,(H,12,14)(H,15,16)
InChIKeyPNLFJEWMGWZBPT-UHFFFAOYSA-N
XLogP-1.55
TPSA105.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.27
LogP ≤ 5-1.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(1-morpholin-4-yl-1-oxopropan-2-yl)acetamide
CID 112684465
N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 86863401
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
CID 67759315
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide
CID 110347736
3-amino-N-(1-morpholin-4-yl-1-oxopropan-2-yl)propanamide
CID 112700894
2-(4-fluorophenoxy)-N-[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]acetamide
CID 94822842
2-anilino-N-(1-morpholin-4-yl-1-oxopropan-2-yl)acetamide
CID 115673259
1-(1-morpholin-4-yl-1-oxopropan-2-yl)-3-propan-2-ylurea
CID 115620431
1-ethyl-3-(1-morpholin-4-yl-1-oxopropan-2-yl)urea
CID 116657745
2-(2,5-dichlorophenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]acetamide
CID 52507381
2-(2,6-dichlorophenyl)-N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]acetamide
CID 94799087
N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-1-carboxamide
CID 116657750

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid?
The IUPAC name of 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid (CID 113408335) is 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid.
What is the SMILES notation for 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid?
The canonical SMILES for 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid is CC(NC(=O)COCC(=O)O)C(=O)N1CCOCC1.
What is the InChIKey of 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid?
The InChIKey is PNLFJEWMGWZBPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O6/c1-8(11(17)13-2-4-18-5-3-13)12-9(14)6-19-7-10(15)16/h8H,2-7H2,1H3,(H,12,14)(H,15,16).
What are the key properties of 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid?
2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid has a molecular weight of 274.27 g/mol, XLogP of -1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid is sourced from PubChem (CID 113408335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).