4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid

C7H10N2O4 — CID 14273524

IUPAC4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid
SMILESO=C(O)CCC(=O)N1CCNC1=O
InChIInChI=1S/C7H10N2O4/c10-5(1-2-6(11)12)9-4-3-8-7(9)13/h1-4H2,(H,8,13)(H,11,12)
InChIKeyOWFWWBZKJKNOJV-UHFFFAOYSA-N
MW186.17 g/mol
LogP-0.60
Rot. Bonds3

About 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid

4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid (PubChem CID 14273524) has the molecular formula C7H10N2O4 and a molecular weight of 186.17 g/mol. Its IUPAC name is 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid.

Molecular Properties

Compound Name4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid
PubChem CID14273524
Molecular FormulaC7H10N2O4
Molecular Weight186.17 g/mol
Exact Mass186.06
IUPAC Name4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid
SMILESO=C(O)CCC(=O)N1CCNC1=O
InChIInChI=1S/C7H10N2O4/c10-5(1-2-6(11)12)9-4-3-8-7(9)13/h1-4H2,(H,8,13)(H,11,12)
InChIKeyOWFWWBZKJKNOJV-UHFFFAOYSA-N
XLogP-0.60
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

L-5-Carboxymethylhydantoin
CID 440092
2,5-Dioxo-1,3-diazolidin-4-ylacetic acid
CID 95492
4-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)butanoic acid
CID 4962194
[(4r)-2,5-Dioxoimidazolidin-4-Yl]acetic Acid
CID 1152519
4-(2,5-Dioxo-imidazolidin-1-yl)-butyric acid
CID 2554535
4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]butanoic acid
CID 2810719
3-Amino-4-oxo-4-((1-((1-pyrrolidinylcarbonyl)amino)ethyl)amino)butanoic acid
CID 382300
4-Oxo-4-(2-pyrrolidin-1-ylethylamino)butanoic acid
CID 3374180
4-[[4-Oxo-3-(2,2,2-trifluoroethyl)imidazolidine-1-carbonyl]amino]butanoic acid
CID 122022665
2-(1-Methyl-2,5-dioxoimidazolidin-4-yl)acetic acid
CID 548276
2-(3-Isopropyl-2,5-dioxoimidazolidin-4-yl)acetic acid
CID 16394958
3-n-Butylhydantoin-5-acetic acid
CID 12942452

Frequently Asked Questions

What is the IUPAC name of 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid?
The IUPAC name of 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid (CID 14273524) is 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid.
What is the SMILES notation for 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid?
The canonical SMILES for 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid is O=C(O)CCC(=O)N1CCNC1=O.
What is the InChIKey of 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid?
The InChIKey is OWFWWBZKJKNOJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O4/c10-5(1-2-6(11)12)9-4-3-8-7(9)13/h1-4H2,(H,8,13)(H,11,12).
What are the key properties of 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid?
4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid has a molecular weight of 186.17 g/mol, XLogP of -0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-4-(2-oxoimidazolidin-1-yl)butanoic acid is sourced from PubChem (CID 14273524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).