hydrazine;3-oxopentanedioic acid

C5H10N2O5 — CID 175290399

IUPAChydrazine;3-oxopentanedioic acid
SMILESNN.O=C(O)CC(=O)CC(=O)O
InChIInChI=1S/C5H6O5.H4N2/c6-3(1-4(7)8)2-5(9)10;1-2/h1-2H2,(H,7,8)(H,9,10);1-2H2
InChIKeyCCQZAOWGABISQC-UHFFFAOYSA-N
MW178.14 g/mol
LogP-1.68
Rot. Bonds4

About hydrazine;3-oxopentanedioic acid

hydrazine;3-oxopentanedioic acid (PubChem CID 175290399) has the molecular formula C5H10N2O5 and a molecular weight of 178.14 g/mol. Its IUPAC name is hydrazine;3-oxopentanedioic acid.

Molecular Properties

Compound Namehydrazine;3-oxopentanedioic acid
PubChem CID175290399
Molecular FormulaC5H10N2O5
Molecular Weight178.14 g/mol
Exact Mass178.06
IUPAC Namehydrazine;3-oxopentanedioic acid
SMILESNN.O=C(O)CC(=O)CC(=O)O
InChIInChI=1S/C5H6O5.H4N2/c6-3(1-4(7)8)2-5(9)10;1-2/h1-2H2,(H,7,8)(H,9,10);1-2H2
InChIKeyCCQZAOWGABISQC-UHFFFAOYSA-N
XLogP-1.68
TPSA143.71 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.14
LogP ≤ 5-1.68
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-(4-carboxy-3-oxobutanoyl)oxy-3,5-dioxopentanoic acid
CID 87350248
3,5,7-trioxononanoic acid
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hydroxylamine;propanedioic acid;vanadium
CID 174908586
propanedioic acid;tungsten
CID 22081019
CID 87073401
CID 87073401
propanedioic acid;terbium
CID 87785742
3,16-dioxooctadecanedioic acid
CID 22644280
3-oxohexanedioic acid;sulfane
CID 174916165
6-methyl-3,5-dioxoheptanoic acid;silver
CID 159846801
methanol;propanedioic acid
CID 87156965
calcium;propanedioic acid;dichloride
CID 172710665
ethene;propanedioic acid
CID 159912302

Frequently Asked Questions

What is the IUPAC name of hydrazine;3-oxopentanedioic acid?
The IUPAC name of hydrazine;3-oxopentanedioic acid (CID 175290399) is hydrazine;3-oxopentanedioic acid.
What is the SMILES notation for hydrazine;3-oxopentanedioic acid?
The canonical SMILES for hydrazine;3-oxopentanedioic acid is NN.O=C(O)CC(=O)CC(=O)O.
What is the InChIKey of hydrazine;3-oxopentanedioic acid?
The InChIKey is CCQZAOWGABISQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6O5.H4N2/c6-3(1-4(7)8)2-5(9)10;1-2/h1-2H2,(H,7,8)(H,9,10);1-2H2.
What are the key properties of hydrazine;3-oxopentanedioic acid?
hydrazine;3-oxopentanedioic acid has a molecular weight of 178.14 g/mol, XLogP of -1.68, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazine;3-oxopentanedioic acid is sourced from PubChem (CID 175290399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).