imidazolidine;oxalic acid

C5H10N2O4 — CID 174299002

IUPACimidazolidine;oxalic acid
SMILESC1CNCN1.O=C(O)C(=O)O
InChIInChI=1S/C3H8N2.C2H2O4/c1-2-5-3-4-1;3-1(4)2(5)6/h4-5H,1-3H2;(H,3,4)(H,5,6)
InChIKeyHTYPZEGTHLOUSU-UHFFFAOYSA-N
MW162.14 g/mol
LogP-1.71
Rot. Bonds

About imidazolidine;oxalic acid

imidazolidine;oxalic acid (PubChem CID 174299002) has the molecular formula C5H10N2O4 and a molecular weight of 162.14 g/mol. Its IUPAC name is imidazolidine;oxalic acid.

Molecular Properties

Compound Nameimidazolidine;oxalic acid
PubChem CID174299002
Molecular FormulaC5H10N2O4
Molecular Weight162.14 g/mol
Exact Mass162.06
IUPAC Nameimidazolidine;oxalic acid
SMILESC1CNCN1.O=C(O)C(=O)O
InChIInChI=1S/C3H8N2.C2H2O4/c1-2-5-3-4-1;3-1(4)2(5)6/h4-5H,1-3H2;(H,3,4)(H,5,6)
InChIKeyHTYPZEGTHLOUSU-UHFFFAOYSA-N
XLogP-1.71
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.14
LogP ≤ 5-1.71
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

benzene;imidazolidine
CID 174737453
imidazolidine;methanol
CID 160892789
imidazolidine;phosphoric acid
CID 174516129
imidazolidine;sulfuric acid
CID 70477093
imidazolidine;hydrofluoride
CID 69023046
1,3,5-triazepane
CID 22147931
oxalic acid;piperidine;hydrate
CID 70586342
imidazolidine;methanamine;sulfuric acid
CID 174596844
2-methylpiperazine;oxalic acid
CID 67824953
calcium;barium(2+);hydride;oxalic acid
CID 174906012
oxalic acid cyanide
CID 172864247
but-2-enedioic acid;piperazine
CID 173189024

Frequently Asked Questions

What is the IUPAC name of imidazolidine;oxalic acid?
The IUPAC name of imidazolidine;oxalic acid (CID 174299002) is imidazolidine;oxalic acid.
What is the SMILES notation for imidazolidine;oxalic acid?
The canonical SMILES for imidazolidine;oxalic acid is C1CNCN1.O=C(O)C(=O)O.
What is the InChIKey of imidazolidine;oxalic acid?
The InChIKey is HTYPZEGTHLOUSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2.C2H2O4/c1-2-5-3-4-1;3-1(4)2(5)6/h4-5H,1-3H2;(H,3,4)(H,5,6).
What are the key properties of imidazolidine;oxalic acid?
imidazolidine;oxalic acid has a molecular weight of 162.14 g/mol, XLogP of -1.71, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazolidine;oxalic acid is sourced from PubChem (CID 174299002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).