(2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid

C6H12N2O4 — CID 25136606

IUPAC(2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid
SMILESC[C@H](NN[C@H](C)C(=O)O)C(=O)O
InChIInChI=1S/C6H12N2O4/c1-3(5(9)10)7-8-4(2)6(11)12/h3-4,7-8H,1-2H3,(H,9,10)(H,11,12)/t3-,4+
InChIKeyBWYIOMOQGUMDBN-ZXZARUISSA-N
MW176.17 g/mol
LogP-0.97
Rot. Bonds5

About (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid

(2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid (PubChem CID 25136606) has the molecular formula C6H12N2O4 and a molecular weight of 176.17 g/mol. Its IUPAC name is (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid.

Molecular Properties

Compound Name(2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid
PubChem CID25136606
Molecular FormulaC6H12N2O4
Molecular Weight176.17 g/mol
Exact Mass176.08
IUPAC Name(2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid
SMILESC[C@H](NN[C@H](C)C(=O)O)C(=O)O
InChIInChI=1S/C6H12N2O4/c1-3(5(9)10)7-8-4(2)6(11)12/h3-4,7-8H,1-2H3,(H,9,10)(H,11,12)/t3-,4+
InChIKeyBWYIOMOQGUMDBN-ZXZARUISSA-N
XLogP-0.97
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 5-0.97
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride
CID 135156009
(2S)-2-[[(1S)-1-carboxyethyl]amino]propanoic acid
CID 10953819
[(1-Carboxyethyl)amino]oxidanyl
CID 165359193
(2S)-2-(iodoamino)propanoic acid
CID 54416510
2-[[(1S)-1-carboxyethyl]amino]propanedioic acid
CID 87604666
2-(1-carboxyethylcarbamoylamino)propanoic acid
CID 14332788
2-[2-(2-methylprop-2-enoyl)hydrazinyl]propanoic acid
CID 88922229
(2S)-2-[2-[[(1S)-1-carboxyethyl]amino]hydrazinyl]-3-hydroxypropanoic acid
CID 90839265
(2S)-2-(acetyl(15N)amino)propanoic acid
CID 102175488
2-(2-phenylhydrazinyl)propanoic acid
CID 77247806
2-[[carboxy(hydroxy)methyl]amino]propanoic acid
CID 21195363
trisodium;2-(1-carboxyethylamino)propanedioic acid;hydride
CID 174988964

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid?
The IUPAC name of (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid (CID 25136606) is (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid.
What is the SMILES notation for (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid?
The canonical SMILES for (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid is C[C@H](NN[C@H](C)C(=O)O)C(=O)O.
What is the InChIKey of (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid?
The InChIKey is BWYIOMOQGUMDBN-ZXZARUISSA-N. The full InChI is InChI=1S/C6H12N2O4/c1-3(5(9)10)7-8-4(2)6(11)12/h3-4,7-8H,1-2H3,(H,9,10)(H,11,12)/t3-,4+.
What are the key properties of (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid?
(2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid has a molecular weight of 176.17 g/mol, XLogP of -0.97, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-[(1S)-1-carboxyethyl]hydrazinyl]propanoic acid is sourced from PubChem (CID 25136606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).