(2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride

C4H11ClN2O2 — CID 135156009

IUPAC(2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride
SMILESCNN[C@@H](C)C(=O)O.Cl
InChIInChI=1S/C4H10N2O2.ClH/c1-3(4(7)8)6-5-2;/h3,5-6H,1-2H3,(H,7,8);1H/t3-;/m0./s1
InChIKeyLGDFBXVDZOVGKQ-DFWYDOINSA-N
MW154.60 g/mol
LogP-0.39
Rot. Bonds3

About (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride

(2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride (PubChem CID 135156009) has the molecular formula C4H11ClN2O2 and a molecular weight of 154.60 g/mol. Its IUPAC name is (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride.

Molecular Properties

Compound Name(2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride
PubChem CID135156009
Molecular FormulaC4H11ClN2O2
Molecular Weight154.60 g/mol
Exact Mass154.05
IUPAC Name(2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride
SMILESCNN[C@@H](C)C(=O)O.Cl
InChIInChI=1S/C4H10N2O2.ClH/c1-3(4(7)8)6-5-2;/h3,5-6H,1-2H3,(H,7,8);1H/t3-;/m0./s1
InChIKeyLGDFBXVDZOVGKQ-DFWYDOINSA-N
XLogP-0.39
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride?
The IUPAC name of (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride (CID 135156009) is (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride.
What is the SMILES notation for (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride?
The canonical SMILES for (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride is CNN[C@@H](C)C(=O)O.Cl.
What is the InChIKey of (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride?
The InChIKey is LGDFBXVDZOVGKQ-DFWYDOINSA-N. The full InChI is InChI=1S/C4H10N2O2.ClH/c1-3(4(7)8)6-5-2;/h3,5-6H,1-2H3,(H,7,8);1H/t3-;/m0./s1.
What are the key properties of (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride?
(2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride has a molecular weight of 154.60 g/mol, XLogP of -0.39, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-methylhydrazinyl)propanoic acid;hydrochloride is sourced from PubChem (CID 135156009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).