Glutaric acid & 2-imidazolidinone

C₈H₁₄N₂O₅ — CID 139045417

About Glutaric acid & 2-imidazolidinone

Glutaric acid & 2-imidazolidinone (PubChem CID 139045417) has the molecular formula C₈H₁₄N₂O₅ and a molecular weight of 218.21 g/mol. Its IUPAC name is imidazolidin-2-one;pentanedioic acid.

Molecular Properties

• Compound Name: Glutaric acid & 2-imidazolidinone
• PubChem CID: 139045417
• Molecular Formula: C₈H₁₄N₂O₅
• Molecular Weight: 218.21 g/mol
• Exact Mass: 218.09
• IUPAC Name: imidazolidin-2-one;pentanedioic acid
• SMILES: O=C(O)CCCC(=O)O.O=C1NCCN1
• InChI: InChI=1S/C5H8O4.C3H6N2O/c6-4(7)2-1-3-5(8)9;6-3-4-1-2-5-3/h1-3H2,(H,6,7)(H,8,9);1-2H2,(H2,4,5,6)
• InChIKey: FXBRJYNPSGEYGE-UHFFFAOYSA-N
• XLogP: -0.37
• TPSA: 115.73 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	218.21
LogP ≤ 5	-0.37
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Glutaric acid & 2-imidazolidinone?

The IUPAC name of Glutaric acid & 2-imidazolidinone (CID 139045417) is imidazolidin-2-one;pentanedioic acid.

What is the SMILES notation for Glutaric acid & 2-imidazolidinone?

The canonical SMILES for Glutaric acid & 2-imidazolidinone is O=C(O)CCCC(=O)O.O=C1NCCN1.

What is the InChIKey of Glutaric acid & 2-imidazolidinone?

The InChIKey is FXBRJYNPSGEYGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O4.C3H6N2O/c6-4(7)2-1-3-5(8)9;6-3-4-1-2-5-3/h1-3H2,(H,6,7)(H,8,9);1-2H2,(H2,4,5,6).

What are the key properties of Glutaric acid & 2-imidazolidinone?

Glutaric acid & 2-imidazolidinone has a molecular weight of 218.21 g/mol, XLogP of -0.37, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Glutaric acid & 2-imidazolidinone is sourced from PubChem (CID 139045417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 139045417 — identifiers, structure, computed properties (public domain)

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