(2R)-2-aminopropanoic acid

C6H14N2O4 — CID 18611140

IUPAC(2R)-2-aminopropanoic acid
SMILESC[C@@H](N)C(=O)O.C[C@@H](N)C(=O)O
InChIInChI=1S/2C3H7NO2/c2*1-2(4)3(5)6/h2*2H,4H2,1H3,(H,5,6)/t2*2-/m11/s1
InChIKeyMKLSLVKLQOIPCY-QRLADXQJSA-N
MW178.19 g/mol
LogP-1.16
Rot. Bonds2

About (2R)-2-aminopropanoic acid

(2R)-2-aminopropanoic acid (PubChem CID 18611140) has the molecular formula C6H14N2O4 and a molecular weight of 178.19 g/mol. Its IUPAC name is (2R)-2-aminopropanoic acid.

Molecular Properties

Compound Name(2R)-2-aminopropanoic acid
PubChem CID18611140
Molecular FormulaC6H14N2O4
Molecular Weight178.19 g/mol
Exact Mass178.10
IUPAC Name(2R)-2-aminopropanoic acid
SMILESC[C@@H](N)C(=O)O.C[C@@H](N)C(=O)O
InChIInChI=1S/2C3H7NO2/c2*1-2(4)3(5)6/h2*2H,4H2,1H3,(H,5,6)/t2*2-/m11/s1
InChIKeyMKLSLVKLQOIPCY-QRLADXQJSA-N
XLogP-1.16
TPSA126.64 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 5-1.16
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-aminopropanoic acid?
The IUPAC name of (2R)-2-aminopropanoic acid (CID 18611140) is (2R)-2-aminopropanoic acid.
What is the SMILES notation for (2R)-2-aminopropanoic acid?
The canonical SMILES for (2R)-2-aminopropanoic acid is C[C@@H](N)C(=O)O.C[C@@H](N)C(=O)O.
What is the InChIKey of (2R)-2-aminopropanoic acid?
The InChIKey is MKLSLVKLQOIPCY-QRLADXQJSA-N. The full InChI is InChI=1S/2C3H7NO2/c2*1-2(4)3(5)6/h2*2H,4H2,1H3,(H,5,6)/t2*2-/m11/s1.
What are the key properties of (2R)-2-aminopropanoic acid?
(2R)-2-aminopropanoic acid has a molecular weight of 178.19 g/mol, XLogP of -1.16, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-aminopropanoic acid is sourced from PubChem (CID 18611140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).