2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid

C11H21N3O10 — CID 88786935

IUPAC2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid
SMILESNC(CC(=O)O)C(=O)O.NC(CCC(=O)O)C(=O)O.NCC(=O)O
InChIInChI=1S/C5H9NO4.C4H7NO4.C2H5NO2/c6-3(5(9)10)1-2-4(7)8;5-2(4(8)9)1-3(6)7;3-1-2(4)5/h3H,1-2,6H2,(H,7,8)(H,9,10);2H,1,5H2,(H,6,7)(H,8,9);1,3H2,(H,4,5)
InChIKeyMOBINDVVGPOXFM-UHFFFAOYSA-N
MW355.30 g/mol
LogP-2.83
Rot. Bonds8

About 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid

2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid (PubChem CID 88786935) has the molecular formula C11H21N3O10 and a molecular weight of 355.30 g/mol. Its IUPAC name is 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid.

Molecular Properties

Compound Name2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid
PubChem CID88786935
Molecular FormulaC11H21N3O10
Molecular Weight355.30 g/mol
Exact Mass355.12
IUPAC Name2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid
SMILESNC(CC(=O)O)C(=O)O.NC(CCC(=O)O)C(=O)O.NCC(=O)O
InChIInChI=1S/C5H9NO4.C4H7NO4.C2H5NO2/c6-3(5(9)10)1-2-4(7)8;5-2(4(8)9)1-3(6)7;3-1-2(4)5/h3H,1-2,6H2,(H,7,8)(H,9,10);2H,1,5H2,(H,6,7)(H,8,9);1,3H2,(H,4,5)
InChIKeyMOBINDVVGPOXFM-UHFFFAOYSA-N
XLogP-2.83
TPSA264.56 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.30
LogP ≤ 5-2.83
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

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Related Compounds

tetrakis((2S)-2-aminobutanedioic acid);(2S)-2-aminopentanedioic acid
CID 160730192
(2S)-2-aminobutanedioic acid;bis((2S)-2-aminopentanedioic acid)
CID 87733347
bis(2-aminoacetic acid);bis(2-aminobutanedioic acid)
CID 174810745
2-aminoacetic acid;2-aminobutanedioic acid
CID 18761839
2-aminobutanedioic acid;2-aminopentanedioic acid;2-aminopropanoic acid
CID 175609716
(2R)-2-amino(1,2,3,4,5-13C5)pentanedioic acid
CID 121494059
2-aminopentanedioic acid
CID 611
2-aminoacetamide;(2S)-2-aminopentanedioic acid
CID 88807329
(2S)-2-aminopentanedioic acid;heptahydrate
CID 156766287
(2R)-2-aminopentanedioic acid;hydrate
CID 87451212
(2S)-2-aminopentanedioic acid;hydrobromide
CID 87753976
(2S)-2-aminopentanedioic acid;chromium
CID 87792997

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid?
The IUPAC name of 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid (CID 88786935) is 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid.
What is the SMILES notation for 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid?
The canonical SMILES for 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid is NC(CC(=O)O)C(=O)O.NC(CCC(=O)O)C(=O)O.NCC(=O)O.
What is the InChIKey of 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid?
The InChIKey is MOBINDVVGPOXFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO4.C4H7NO4.C2H5NO2/c6-3(5(9)10)1-2-4(7)8;5-2(4(8)9)1-3(6)7;3-1-2(4)5/h3H,1-2,6H2,(H,7,8)(H,9,10);2H,1,5H2,(H,6,7)(H,8,9);1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid?
2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid has a molecular weight of 355.30 g/mol, XLogP of -2.83, 8 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;2-aminobutanedioic acid;2-aminopentanedioic acid is sourced from PubChem (CID 88786935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).