(3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid

C4H9N5O2 — CID 88896152

IUPAC(3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid
SMILESC=NN/C(=N\N)C(N)C(=O)O
InChIInChI=1S/C4H9N5O2/c1-7-9-3(8-6)2(5)4(10)11/h2H,1,5-6H2,(H,8,9)(H,10,11)
InChIKeyQJLQVJIMOSBCBD-UHFFFAOYSA-N
MW159.15 g/mol
LogP-2.12
Rot. Bonds3

About (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid

(3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid (PubChem CID 88896152) has the molecular formula C4H9N5O2 and a molecular weight of 159.15 g/mol. Its IUPAC name is (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid.

Molecular Properties

Compound Name(3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid
PubChem CID88896152
Molecular FormulaC4H9N5O2
Molecular Weight159.15 g/mol
Exact Mass159.08
IUPAC Name(3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid
SMILESC=NN/C(=N\N)C(N)C(=O)O
InChIInChI=1S/C4H9N5O2/c1-7-9-3(8-6)2(5)4(10)11/h2H,1,5-6H2,(H,8,9)(H,10,11)
InChIKeyQJLQVJIMOSBCBD-UHFFFAOYSA-N
XLogP-2.12
TPSA126.09 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.15
LogP ≤ 5-2.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid?
The IUPAC name of (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid (CID 88896152) is (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid.
What is the SMILES notation for (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid?
The canonical SMILES for (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid is C=NN/C(=N\N)C(N)C(=O)O.
What is the InChIKey of (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid?
The InChIKey is QJLQVJIMOSBCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N5O2/c1-7-9-3(8-6)2(5)4(10)11/h2H,1,5-6H2,(H,8,9)(H,10,11).
What are the key properties of (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid?
(3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid has a molecular weight of 159.15 g/mol, XLogP of -2.12, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-2-amino-3-hydrazinylidene-3-(2-methylidenehydrazinyl)propanoic acid is sourced from PubChem (CID 88896152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).