2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid

C5H10N2O4 — CID 3246319

IUPAC2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid
SMILESN[C@H](CO)C(=O)NCC(=O)O
InChIInChI=1S/C5H10N2O4/c6-3(2-8)5(11)7-1-4(9)10/h3,8H,1-2,6H2,(H,7,11)(H,9,10)/t3-/m1/s1
InChIKeyWOUIMBGNEUWXQG-GSVOUGTGSA-N
MW162.14 g/mol
LogP-2.49
Rot. Bonds4

About 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid

2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid (PubChem CID 3246319) has the molecular formula C5H10N2O4 and a molecular weight of 162.14 g/mol. Its IUPAC name is 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid
PubChem CID3246319
Molecular FormulaC5H10N2O4
Molecular Weight162.14 g/mol
Exact Mass162.06
IUPAC Name2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid
SMILESN[C@H](CO)C(=O)NCC(=O)O
InChIInChI=1S/C5H10N2O4/c6-3(2-8)5(11)7-1-4(9)10/h3,8H,1-2,6H2,(H,7,11)(H,9,10)/t3-/m1/s1
InChIKeyWOUIMBGNEUWXQG-GSVOUGTGSA-N
XLogP-2.49
TPSA112.65 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.14
LogP ≤ 5-2.49
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid?
The IUPAC name of 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid (CID 3246319) is 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid.
What is the SMILES notation for 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid?
The canonical SMILES for 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid is N[C@H](CO)C(=O)NCC(=O)O.
What is the InChIKey of 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid?
The InChIKey is WOUIMBGNEUWXQG-GSVOUGTGSA-N. The full InChI is InChI=1S/C5H10N2O4/c6-3(2-8)5(11)7-1-4(9)10/h3,8H,1-2,6H2,(H,7,11)(H,9,10)/t3-/m1/s1.
What are the key properties of 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid?
2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid has a molecular weight of 162.14 g/mol, XLogP of -2.49, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-2-amino-3-hydroxypropanoyl]amino]acetic acid is sourced from PubChem (CID 3246319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).