methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate

C6H11NO4 — CID 11041006

IUPACmethyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate
SMILESCOC(=O)CNC(=O)[C@H](C)O
InChIInChI=1S/C6H11NO4/c1-4(8)6(10)7-3-5(9)11-2/h4,8H,3H2,1-2H3,(H,7,10)/t4-/m0/s1
InChIKeyUVXPEBUDYTWIPG-BYPYZUCNSA-N
MW161.16 g/mol
LogP-1.34
Rot. Bonds3

About methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate

methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate (PubChem CID 11041006) has the molecular formula C6H11NO4 and a molecular weight of 161.16 g/mol. Its IUPAC name is methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate.

Molecular Properties

Compound Namemethyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate
PubChem CID11041006
Molecular FormulaC6H11NO4
Molecular Weight161.16 g/mol
Exact Mass161.07
IUPAC Namemethyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate
SMILESCOC(=O)CNC(=O)[C@H](C)O
InChIInChI=1S/C6H11NO4/c1-4(8)6(10)7-3-5(9)11-2/h4,8H,3H2,1-2H3,(H,7,10)/t4-/m0/s1
InChIKeyUVXPEBUDYTWIPG-BYPYZUCNSA-N
XLogP-1.34
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl 2-(2-hydroxypropanoylamino)acetate
CID 169085959
methyl 2-(2-methylsulfonylpropanoylamino)acetate
CID 115582753
methyl 2-[[2-(aminomethyl)-3-methylbutanoyl]amino]acetate
CID 65229564
methyl 2-[[(2S)-2-[(2-aminoacetyl)amino]propanoyl]amino]acetate
CID 54222962
methyl 2-(methoxycarbonylamino)acetate
CID 14133519
methyl 2-[[(2S)-2-(2,2-dimethylpropanoylamino)-3-methylbutanoyl]amino]acetate
CID 130396779
methyl 2-(2-butylsulfanylpropanoylamino)acetate
CID 134037889
2-hydroxy-N-(3-methoxypropyl)propanamide
CID 43558715
methyl 2-[(2-propan-2-yloxyacetyl)amino]acetate
CID 112686620
methyl 2-(3-aminobutanoylamino)acetate
CID 60914832
tert-butyl N-[2-[[(2R)-2-hydroxypropanoyl]amino]ethyl]carbamate
CID 134128297
(2R)-2-hydroxy-N-(2-hydroxy-2-methylpropyl)propanamide
CID 131159624

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate?
The IUPAC name of methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate (CID 11041006) is methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate.
What is the SMILES notation for methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate?
The canonical SMILES for methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate is COC(=O)CNC(=O)[C@H](C)O.
What is the InChIKey of methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate?
The InChIKey is UVXPEBUDYTWIPG-BYPYZUCNSA-N. The full InChI is InChI=1S/C6H11NO4/c1-4(8)6(10)7-3-5(9)11-2/h4,8H,3H2,1-2H3,(H,7,10)/t4-/m0/s1.
What are the key properties of methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate?
methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate has a molecular weight of 161.16 g/mol, XLogP of -1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[(2S)-2-hydroxypropanoyl]amino]acetate is sourced from PubChem (CID 11041006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).