(2R)-2-(2-diazohydrazinyl)propanoic acid

C3H6N4O2 — CID 23623073

IUPAC(2R)-2-(2-diazohydrazinyl)propanoic acid
SMILESC[C@@H](NN=[N+]=[N-])C(=O)O
InChIInChI=1S/C3H6N4O2/c1-2(3(8)9)5-7-6-4/h2,5H,1H3,(H,8,9)/t2-/m1/s1
InChIKeyKRCVJTNGGWBYEW-UWTATZPHSA-N
MW130.11 g/mol
LogP0.27
Rot. Bonds3

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

(2R)-2-(2-diazohydrazinyl)propanoic acid (PubChem CID 23623073) has the molecular formula C3H6N4O2 and a molecular weight of 130.11 g/mol. Its IUPAC name is (2R)-2-(2-diazohydrazinyl)propanoic acid.

Molecular Properties

Compound Name(2R)-2-(2-diazohydrazinyl)propanoic acid
PubChem CID23623073
Molecular FormulaC3H6N4O2
Molecular Weight130.11 g/mol
Exact Mass130.05
IUPAC Name(2R)-2-(2-diazohydrazinyl)propanoic acid
SMILESC[C@@H](NN=[N+]=[N-])C(=O)O
InChIInChI=1S/C3H6N4O2/c1-2(3(8)9)5-7-6-4/h2,5H,1H3,(H,8,9)/t2-/m1/s1
InChIKeyKRCVJTNGGWBYEW-UWTATZPHSA-N
XLogP0.27
TPSA98.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.11
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-diazohydrazinyl)propanoic acid?
The IUPAC name of (2R)-2-(2-diazohydrazinyl)propanoic acid (CID 23623073) is (2R)-2-(2-diazohydrazinyl)propanoic acid.
What is the SMILES notation for (2R)-2-(2-diazohydrazinyl)propanoic acid?
The canonical SMILES for (2R)-2-(2-diazohydrazinyl)propanoic acid is C[C@@H](NN=[N+]=[N-])C(=O)O.
What is the InChIKey of (2R)-2-(2-diazohydrazinyl)propanoic acid?
The InChIKey is KRCVJTNGGWBYEW-UWTATZPHSA-N. The full InChI is InChI=1S/C3H6N4O2/c1-2(3(8)9)5-7-6-4/h2,5H,1H3,(H,8,9)/t2-/m1/s1.
What are the key properties of (2R)-2-(2-diazohydrazinyl)propanoic acid?
(2R)-2-(2-diazohydrazinyl)propanoic acid has a molecular weight of 130.11 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-diazohydrazinyl)propanoic acid is sourced from PubChem (CID 23623073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).