2-aminopropanoic acid;2-hydroxypropanamide

C6H14N2O4 — CID 174928864

IUPAC2-aminopropanoic acid;2-hydroxypropanamide
SMILESCC(N)C(=O)O.CC(O)C(N)=O
InChIInChI=1S/2C3H7NO2/c1-2(5)3(4)6;1-2(4)3(5)6/h2,5H,1H3,(H2,4,6);2H,4H2,1H3,(H,5,6)
InChIKeyMLRUOOZDXTUERE-UHFFFAOYSA-N
MW178.19 g/mol
LogP-1.73
Rot. Bonds2

About 2-aminopropanoic acid;2-hydroxypropanamide

2-aminopropanoic acid;2-hydroxypropanamide (PubChem CID 174928864) has the molecular formula C6H14N2O4 and a molecular weight of 178.19 g/mol. Its IUPAC name is 2-aminopropanoic acid;2-hydroxypropanamide.

Molecular Properties

Compound Name2-aminopropanoic acid;2-hydroxypropanamide
PubChem CID174928864
Molecular FormulaC6H14N2O4
Molecular Weight178.19 g/mol
Exact Mass178.10
IUPAC Name2-aminopropanoic acid;2-hydroxypropanamide
SMILESCC(N)C(=O)O.CC(O)C(N)=O
InChIInChI=1S/2C3H7NO2/c1-2(5)3(4)6;1-2(4)3(5)6/h2,5H,1H3,(H2,4,6);2H,4H2,1H3,(H,5,6)
InChIKeyMLRUOOZDXTUERE-UHFFFAOYSA-N
XLogP-1.73
TPSA126.64 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 5-1.73
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-aminopropanoic acid
CID 18446182
(2S)-2-aminopropanoic acid
CID 5950
(2R)-2-aminopropanoic acid
CID 18611140
CID 86589108
CID 86589108
(2R)-2-aminopropanoic acid;phosphane
CID 157319334
tris(2-aminopropanoic acid);cobalt
CID 50909705
(2S)-2-aminopropanoic acid;polane
CID 173022618
trisodium;(2S)-2-aminopropanoic acid;hydride
CID 174824458
potassium;2-aminopropanoic acid;hydride
CID 173162937
acetic acid;(2S)-2-aminopropanoic acid
CID 87112640
acetic acid;(2S)-2-aminopropanoic acid
CID 87950802
dimethylphosphane;2-hydroxypropanamide
CID 174842276

Frequently Asked Questions

What is the IUPAC name of 2-aminopropanoic acid;2-hydroxypropanamide?
The IUPAC name of 2-aminopropanoic acid;2-hydroxypropanamide (CID 174928864) is 2-aminopropanoic acid;2-hydroxypropanamide.
What is the SMILES notation for 2-aminopropanoic acid;2-hydroxypropanamide?
The canonical SMILES for 2-aminopropanoic acid;2-hydroxypropanamide is CC(N)C(=O)O.CC(O)C(N)=O.
What is the InChIKey of 2-aminopropanoic acid;2-hydroxypropanamide?
The InChIKey is MLRUOOZDXTUERE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7NO2/c1-2(5)3(4)6;1-2(4)3(5)6/h2,5H,1H3,(H2,4,6);2H,4H2,1H3,(H,5,6).
What are the key properties of 2-aminopropanoic acid;2-hydroxypropanamide?
2-aminopropanoic acid;2-hydroxypropanamide has a molecular weight of 178.19 g/mol, XLogP of -1.73, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopropanoic acid;2-hydroxypropanamide is sourced from PubChem (CID 174928864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).