2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid

C8H17N3O5 — CID 88604532

IUPAC2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid
SMILESCC(N)C(=O)N[C@H](C)C(=O)O.NCC(=O)O
InChIInChI=1S/C6H12N2O3.C2H5NO2/c1-3(7)5(9)8-4(2)6(10)11;3-1-2(4)5/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11);1,3H2,(H,4,5)/t3?,4-;/m1./s1
InChIKeyHHLGXFCSPJQRGX-ZAQOELHGSA-N
MW235.24 g/mol
LogP-2.05
Rot. Bonds4

About 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid

2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid (PubChem CID 88604532) has the molecular formula C8H17N3O5 and a molecular weight of 235.24 g/mol. Its IUPAC name is 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid.

Molecular Properties

Compound Name2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid
PubChem CID88604532
Molecular FormulaC8H17N3O5
Molecular Weight235.24 g/mol
Exact Mass235.12
IUPAC Name2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid
SMILESCC(N)C(=O)N[C@H](C)C(=O)O.NCC(=O)O
InChIInChI=1S/C6H12N2O3.C2H5NO2/c1-3(7)5(9)8-4(2)6(10)11;3-1-2(4)5/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11);1,3H2,(H,4,5)/t3?,4-;/m1./s1
InChIKeyHHLGXFCSPJQRGX-ZAQOELHGSA-N
XLogP-2.05
TPSA155.74 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 5-2.05
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[(2S)-2-aminopropanoyl]amino]propanoic acid;hydrochloride
CID 88920207
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-(15N)azanyl(1,2,3-13C3)propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoic acid
CID 132503633
(2R)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-aminopropanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoic acid
CID 92840389
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoic acid
CID 5478841
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoic acid
CID 16758239
(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-aminopropanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoic acid
CID 101209600
(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoic acid;hydron;pentahydrate
CID 131855428
2-[2-[2-[2-(2-aminopropanoylamino)propanoylamino]propanoylamino]propanoylamino]propanoic acid
CID 4079599
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]propanoic acid;hydrate
CID 91872910
4-(2-aminopropanoylamino)-5-(1-carboxyethylamino)-5-oxopentanoic acid
CID 18218343
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-hydroxypropanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoic acid
CID 71350639
2-[2-[[2-(2-aminopropanoylamino)-3-hydroxypropanoyl]amino]propanoylamino]propanoic acid
CID 18238530

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid?
The IUPAC name of 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid (CID 88604532) is 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid.
What is the SMILES notation for 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid?
The canonical SMILES for 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid is CC(N)C(=O)N[C@H](C)C(=O)O.NCC(=O)O.
What is the InChIKey of 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid?
The InChIKey is HHLGXFCSPJQRGX-ZAQOELHGSA-N. The full InChI is InChI=1S/C6H12N2O3.C2H5NO2/c1-3(7)5(9)8-4(2)6(10)11;3-1-2(4)5/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11);1,3H2,(H,4,5)/t3?,4-;/m1./s1.
What are the key properties of 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid?
2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid has a molecular weight of 235.24 g/mol, XLogP of -2.05, 4 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid is sourced from PubChem (CID 88604532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).