2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide

C14H15N3O3 — CID 127816376

IUPAC2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide
SMILESO=C1CCC(NC(=O)c2ccnc(C3CC3)c2)C(=O)N1
InChIInChI=1S/C14H15N3O3/c18-12-4-3-10(14(20)17-12)16-13(19)9-5-6-15-11(7-9)8-1-2-8/h5-8,10H,1-4H2,(H,16,19)(H,17,18,20)
InChIKeyCFABCDQHFHOBRC-UHFFFAOYSA-N
MW273.29 g/mol
LogP0.49
Rot. Bonds3

About 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide

2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide (PubChem CID 127816376) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide
PubChem CID127816376
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide
SMILESO=C1CCC(NC(=O)c2ccnc(C3CC3)c2)C(=O)N1
InChIInChI=1S/C14H15N3O3/c18-12-4-3-10(14(20)17-12)16-13(19)9-5-6-15-11(7-9)8-1-2-8/h5-8,10H,1-4H2,(H,16,19)(H,17,18,20)
InChIKeyCFABCDQHFHOBRC-UHFFFAOYSA-N
XLogP0.49
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 50.49
H-Bond Donors ≤ 52
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 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide (CID 127816376) is 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide is O=C1CCC(NC(=O)c2ccnc(C3CC3)c2)C(=O)N1.
What is the InChIKey of 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide?
The InChIKey is CFABCDQHFHOBRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-12-4-3-10(14(20)17-12)16-13(19)9-5-6-15-11(7-9)8-1-2-8/h5-8,10H,1-4H2,(H,16,19)(H,17,18,20).
What are the key properties of 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide?
2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide has a molecular weight of 273.29 g/mol, XLogP of 0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2,6-dioxopiperidin-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 127816376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).