3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide

C11H10FN3O3 — CID 154865863

IUPAC3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide
SMILESCN1C(=O)CC(NC(=O)c2ncccc2F)C1=O
InChIInChI=1S/C11H10FN3O3/c1-15-8(16)5-7(11(15)18)14-10(17)9-6(12)3-2-4-13-9/h2-4,7H,5H2,1H3,(H,14,17)
InChIKeyMEIZLDGDAMKECY-UHFFFAOYSA-N
MW251.22 g/mol
LogP-0.29
Rot. Bonds2

About 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide

3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide (PubChem CID 154865863) has the molecular formula C11H10FN3O3 and a molecular weight of 251.22 g/mol. Its IUPAC name is 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide
PubChem CID154865863
Molecular FormulaC11H10FN3O3
Molecular Weight251.22 g/mol
Exact Mass251.07
IUPAC Name3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide
SMILESCN1C(=O)CC(NC(=O)c2ncccc2F)C1=O
InChIInChI=1S/C11H10FN3O3/c1-15-8(16)5-7(11(15)18)14-10(17)9-6(12)3-2-4-13-9/h2-4,7H,5H2,1H3,(H,14,17)
InChIKeyMEIZLDGDAMKECY-UHFFFAOYSA-N
XLogP-0.29
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.22
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide?
The IUPAC name of 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide (CID 154865863) is 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide is CN1C(=O)CC(NC(=O)c2ncccc2F)C1=O.
What is the InChIKey of 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide?
The InChIKey is MEIZLDGDAMKECY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O3/c1-15-8(16)5-7(11(15)18)14-10(17)9-6(12)3-2-4-13-9/h2-4,7H,5H2,1H3,(H,14,17).
What are the key properties of 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide?
3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide has a molecular weight of 251.22 g/mol, XLogP of -0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 154865863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).