2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid

C7H19N3O5 — CID 174737478

IUPAC2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid
SMILESCC(O)C(=O)O.NCC(=O)O.NCCN
InChIInChI=1S/C3H6O3.C2H8N2.C2H5NO2/c1-2(4)3(5)6;3-1-2-4;3-1-2(4)5/h2,4H,1H3,(H,5,6);1-4H2;1,3H2,(H,4,5)
InChIKeyDQLYSIYNSYNFPP-UHFFFAOYSA-N
MW225.24 g/mol
LogP-2.61
Rot. Bonds3

About 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid

2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid (PubChem CID 174737478) has the molecular formula C7H19N3O5 and a molecular weight of 225.24 g/mol. Its IUPAC name is 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid.

Molecular Properties

Compound Name2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid
PubChem CID174737478
Molecular FormulaC7H19N3O5
Molecular Weight225.24 g/mol
Exact Mass225.13
IUPAC Name2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid
SMILESCC(O)C(=O)O.NCC(=O)O.NCCN
InChIInChI=1S/C3H6O3.C2H8N2.C2H5NO2/c1-2(4)3(5)6;3-1-2-4;3-1-2(4)5/h2,4H,1H3,(H,5,6);1-4H2;1,3H2,(H,4,5)
InChIKeyDQLYSIYNSYNFPP-UHFFFAOYSA-N
XLogP-2.61
TPSA172.89 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500225.24
LogP ≤ 5-2.61
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

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Related Compounds

2-hydroxypropanoic acid
CID 87075455
2-hydroxypropanoic acid;propanedioic acid
CID 87923632
2-hydroxypropanoic acid;propanoic acid
CID 175004384
2-aminoethane-1,1,1-triol;2-hydroxypropanoic acid
CID 158538146
pentaheptacontacalcium;(2-hydroxypropanoic acid)
CID 173046474
bis(2-hydroxypropanoic acid);titanium
CID 173417954
CID 131877347
CID 131877347
calcium hexakis(2-hydroxypropanoic acid)
CID 162368187
2-hydroxypropanoic acid;mercury
CID 88512020
CID 123133976
CID 123133976
CID 129137181
CID 129137181
2-hydroxypropanoic acid;tetrahydrate
CID 141343914

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid?
The IUPAC name of 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid (CID 174737478) is 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid.
What is the SMILES notation for 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid?
The canonical SMILES for 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid is CC(O)C(=O)O.NCC(=O)O.NCCN.
What is the InChIKey of 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid?
The InChIKey is DQLYSIYNSYNFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O3.C2H8N2.C2H5NO2/c1-2(4)3(5)6;3-1-2-4;3-1-2(4)5/h2,4H,1H3,(H,5,6);1-4H2;1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid?
2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid has a molecular weight of 225.24 g/mol, XLogP of -2.61, 3 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;ethane-1,2-diamine;2-hydroxypropanoic acid is sourced from PubChem (CID 174737478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).