(2S)-2-aminopropanoic acid

C3H7NO2 — CID 5950

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IUPAC(2S)-2-aminopropanoic acid
SMILESC[C@H](N)C(=O)O
InChIInChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
InChIKeyQNAYBMKLOCPYGJ-REOHCLBHSA-N
MW89.09 g/mol
LogP-0.58
Rot. Bonds1

About (2S)-2-aminopropanoic acid

(2S)-2-aminopropanoic acid (PubChem CID 5950) has the molecular formula C3H7NO2 and a molecular weight of 89.09 g/mol. Its IUPAC name is (2S)-2-aminopropanoic acid.

Molecular Properties

Compound Name(2S)-2-aminopropanoic acid
PubChem CID5950
Molecular FormulaC3H7NO2
Molecular Weight89.09 g/mol
Exact Mass89.05
IUPAC Name(2S)-2-aminopropanoic acid
SMILESC[C@H](N)C(=O)O
InChIInChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
InChIKeyQNAYBMKLOCPYGJ-REOHCLBHSA-N
XLogP-0.58
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.09
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-aminopropanoic acid
CID 18446182
(2R)-2-aminopropanoic acid
CID 18611140
CID 86589108
CID 86589108
(2S)-2-aminopropanoic acid;polane
CID 173022618
(2R)-2-aminopropanoic acid;phosphane
CID 157319334
tris(2-aminopropanoic acid);cobalt
CID 50909705
trisodium;(2S)-2-aminopropanoic acid;hydride
CID 174824458
acetic acid;(2S)-2-aminopropanoic acid
CID 87112640
acetic acid;(2S)-2-aminopropanoic acid
CID 87950802
potassium;2-aminopropanoic acid;hydride
CID 173162937
calcium;(2S)-2-aminopropanoic acid;dichloride
CID 173075157
(2S)-2-aminopropanoic acid;methane;palladium
CID 87359274

Frequently Asked Questions

What is the IUPAC name of (2S)-2-aminopropanoic acid?
The IUPAC name of (2S)-2-aminopropanoic acid (CID 5950) is (2S)-2-aminopropanoic acid.
What is the SMILES notation for (2S)-2-aminopropanoic acid?
The canonical SMILES for (2S)-2-aminopropanoic acid is C[C@H](N)C(=O)O.
What is the InChIKey of (2S)-2-aminopropanoic acid?
The InChIKey is QNAYBMKLOCPYGJ-REOHCLBHSA-N. The full InChI is InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1.
What are the key properties of (2S)-2-aminopropanoic acid?
(2S)-2-aminopropanoic acid has a molecular weight of 89.09 g/mol, XLogP of -0.58, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-aminopropanoic acid is sourced from PubChem (CID 5950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).