2-aminoacetic acid;2-amino-3-hydroxybutanamide

C6H15N3O4 — CID 18421386

IUPAC2-aminoacetic acid;2-amino-3-hydroxybutanamide
SMILESCC(O)C(N)C(N)=O.NCC(=O)O
InChIInChI=1S/C4H10N2O2.C2H5NO2/c1-2(7)3(5)4(6)8;3-1-2(4)5/h2-3,7H,5H2,1H3,(H2,6,8);1,3H2,(H,4,5)
InChIKeyPQFBXDZFQDCVKA-UHFFFAOYSA-N
MW193.20 g/mol
LogP-2.79
Rot. Bonds3

About 2-aminoacetic acid;2-amino-3-hydroxybutanamide

2-aminoacetic acid;2-amino-3-hydroxybutanamide (PubChem CID 18421386) has the molecular formula C6H15N3O4 and a molecular weight of 193.20 g/mol. Its IUPAC name is 2-aminoacetic acid;2-amino-3-hydroxybutanamide.

Molecular Properties

Compound Name2-aminoacetic acid;2-amino-3-hydroxybutanamide
PubChem CID18421386
Molecular FormulaC6H15N3O4
Molecular Weight193.20 g/mol
Exact Mass193.11
IUPAC Name2-aminoacetic acid;2-amino-3-hydroxybutanamide
SMILESCC(O)C(N)C(N)=O.NCC(=O)O
InChIInChI=1S/C4H10N2O2.C2H5NO2/c1-2(7)3(5)4(6)8;3-1-2(4)5/h2-3,7H,5H2,1H3,(H2,6,8);1,3H2,(H,4,5)
InChIKeyPQFBXDZFQDCVKA-UHFFFAOYSA-N
XLogP-2.79
TPSA152.66 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 5-2.79
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S)-2-amino-3-hydroxybutanamide
CID 22877840
2-amino-3-hydroxybutanoic acid;urea
CID 174908114
2-aminoacetic acid;(2S)-2-amino-3-methylbutanoic acid;hydrochloride
CID 159922331
(2S,3R)-2-amino-3-hydroxybutanoic acid
CID 158974218
2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid
CID 174737478
(2S,3S)-2-amino-3-hydroxybutanoic acid;hydrochloride
CID 122360052
2-amino-3-hydroxybutanoic acid;selane
CID 174980406
2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid
CID 87257190
2-amino-3-hydroxybutanoic acid;2-oxobutanoic acid
CID 19098050
tris(2-aminoacetic acid);2-aminopropanoic acid;sulfuric acid
CID 21441171
2-aminoacetic acid;ethanamine
CID 162171079
2-aminoacetic acid;cadmium
CID 87269769

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;2-amino-3-hydroxybutanamide?
The IUPAC name of 2-aminoacetic acid;2-amino-3-hydroxybutanamide (CID 18421386) is 2-aminoacetic acid;2-amino-3-hydroxybutanamide.
What is the SMILES notation for 2-aminoacetic acid;2-amino-3-hydroxybutanamide?
The canonical SMILES for 2-aminoacetic acid;2-amino-3-hydroxybutanamide is CC(O)C(N)C(N)=O.NCC(=O)O.
What is the InChIKey of 2-aminoacetic acid;2-amino-3-hydroxybutanamide?
The InChIKey is PQFBXDZFQDCVKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2.C2H5NO2/c1-2(7)3(5)4(6)8;3-1-2(4)5/h2-3,7H,5H2,1H3,(H2,6,8);1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;2-amino-3-hydroxybutanamide?
2-aminoacetic acid;2-amino-3-hydroxybutanamide has a molecular weight of 193.20 g/mol, XLogP of -2.79, 3 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;2-amino-3-hydroxybutanamide is sourced from PubChem (CID 18421386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).