(2R)-2-(2-hydroxyethylamino)propanoic acid

C5H11NO3 — CID 5487292

IUPAC(2R)-2-(2-hydroxyethylamino)propanoic acid
SMILESC[C@@H](NCCO)C(=O)O
InChIInChI=1S/C5H11NO3/c1-4(5(8)9)6-2-3-7/h4,6-7H,2-3H2,1H3,(H,8,9)/t4-/m1/s1
InChIKeyJOOSUPODUVRSRP-SCSAIBSYSA-N
MW133.15 g/mol
LogP-0.96
Rot. Bonds4

About (2R)-2-(2-hydroxyethylamino)propanoic acid

(2R)-2-(2-hydroxyethylamino)propanoic acid (PubChem CID 5487292) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is (2R)-2-(2-hydroxyethylamino)propanoic acid.

Molecular Properties

Compound Name(2R)-2-(2-hydroxyethylamino)propanoic acid
PubChem CID5487292
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Name(2R)-2-(2-hydroxyethylamino)propanoic acid
SMILESC[C@@H](NCCO)C(=O)O
InChIInChI=1S/C5H11NO3/c1-4(5(8)9)6-2-3-7/h4,6-7H,2-3H2,1H3,(H,8,9)/t4-/m1/s1
InChIKeyJOOSUPODUVRSRP-SCSAIBSYSA-N
XLogP-0.96
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-hydroxyethylamino)propanoic acid?
The IUPAC name of (2R)-2-(2-hydroxyethylamino)propanoic acid (CID 5487292) is (2R)-2-(2-hydroxyethylamino)propanoic acid.
What is the SMILES notation for (2R)-2-(2-hydroxyethylamino)propanoic acid?
The canonical SMILES for (2R)-2-(2-hydroxyethylamino)propanoic acid is C[C@@H](NCCO)C(=O)O.
What is the InChIKey of (2R)-2-(2-hydroxyethylamino)propanoic acid?
The InChIKey is JOOSUPODUVRSRP-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H11NO3/c1-4(5(8)9)6-2-3-7/h4,6-7H,2-3H2,1H3,(H,8,9)/t4-/m1/s1.
What are the key properties of (2R)-2-(2-hydroxyethylamino)propanoic acid?
(2R)-2-(2-hydroxyethylamino)propanoic acid has a molecular weight of 133.15 g/mol, XLogP of -0.96, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-hydroxyethylamino)propanoic acid is sourced from PubChem (CID 5487292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).