5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione

C18H15N3O4 — CID 71585450

IUPAC5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione
SMILESCc1cccn(CC2(c3cc4ccccc4o3)NC(=O)NC2=O)c1=O
InChIInChI=1S/C18H15N3O4/c1-11-5-4-8-21(15(11)22)10-18(16(23)19-17(24)20-18)14-9-12-6-2-3-7-13(12)25-14/h2-9H,10H2,1H3,(H2,19,20,23,24)
InChIKeySRLRXKVJEWIFTA-UHFFFAOYSA-N
MW337.34 g/mol
LogP1.64
Rot. Bonds3

About 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione

5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione (PubChem CID 71585450) has the molecular formula C18H15N3O4 and a molecular weight of 337.34 g/mol. Its IUPAC name is 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione
PubChem CID71585450
Molecular FormulaC18H15N3O4
Molecular Weight337.34 g/mol
Exact Mass337.11
IUPAC Name5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione
SMILESCc1cccn(CC2(c3cc4ccccc4o3)NC(=O)NC2=O)c1=O
InChIInChI=1S/C18H15N3O4/c1-11-5-4-8-21(15(11)22)10-18(16(23)19-17(24)20-18)14-9-12-6-2-3-7-13(12)25-14/h2-9H,10H2,1H3,(H2,19,20,23,24)
InChIKeySRLRXKVJEWIFTA-UHFFFAOYSA-N
XLogP1.64
TPSA93.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione (CID 71585450) is 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione is Cc1cccn(CC2(c3cc4ccccc4o3)NC(=O)NC2=O)c1=O.
What is the InChIKey of 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione?
The InChIKey is SRLRXKVJEWIFTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O4/c1-11-5-4-8-21(15(11)22)10-18(16(23)19-17(24)20-18)14-9-12-6-2-3-7-13(12)25-14/h2-9H,10H2,1H3,(H2,19,20,23,24).
What are the key properties of 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione?
5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione has a molecular weight of 337.34 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-benzofuran-2-yl)-5-[(3-methyl-2-oxo-1-pyridinyl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 71585450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).