5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione

C16H20N4O4 — CID 143990391

IUPAC5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione
SMILESCCCOCCN(C)c1ccc2oc(C3NC(=O)NC3=O)cc2n1
InChIInChI=1S/C16H20N4O4/c1-3-7-23-8-6-20(2)13-5-4-11-10(17-13)9-12(24-11)14-15(21)19-16(22)18-14/h4-5,9,14H,3,6-8H2,1-2H3,(H2,18,19,21,22)
InChIKeyQJDWVJVMEGYMHZ-UHFFFAOYSA-N
MW332.36 g/mol
LogP1.57
Rot. Bonds7

About 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione

5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione (PubChem CID 143990391) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione
PubChem CID143990391
Molecular FormulaC16H20N4O4
Molecular Weight332.36 g/mol
Exact Mass332.15
IUPAC Name5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione
SMILESCCCOCCN(C)c1ccc2oc(C3NC(=O)NC3=O)cc2n1
InChIInChI=1S/C16H20N4O4/c1-3-7-23-8-6-20(2)13-5-4-11-10(17-13)9-12(24-11)14-15(21)19-16(22)18-14/h4-5,9,14H,3,6-8H2,1-2H3,(H2,18,19,21,22)
InChIKeyQJDWVJVMEGYMHZ-UHFFFAOYSA-N
XLogP1.57
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione?
The IUPAC name of 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione (CID 143990391) is 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione?
The canonical SMILES for 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione is CCCOCCN(C)c1ccc2oc(C3NC(=O)NC3=O)cc2n1.
What is the InChIKey of 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione?
The InChIKey is QJDWVJVMEGYMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O4/c1-3-7-23-8-6-20(2)13-5-4-11-10(17-13)9-12(24-11)14-15(21)19-16(22)18-14/h4-5,9,14H,3,6-8H2,1-2H3,(H2,18,19,21,22).
What are the key properties of 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione?
5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione has a molecular weight of 332.36 g/mol, XLogP of 1.57, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[methyl(2-propoxyethyl)amino]furo[3,2-b]pyridin-2-yl]imidazolidine-2,4-dione is sourced from PubChem (CID 143990391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).