2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide

C12H14N4O3 — CID 155218183

IUPAC2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESNc1cccnc1CC(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C12H14N4O3/c13-7-2-1-5-14-9(7)6-11(18)15-8-3-4-10(17)16-12(8)19/h1-2,5,8H,3-4,6,13H2,(H,15,18)(H,16,17,19)
InChIKeyFWTLWWVRTKQIIH-UHFFFAOYSA-N
MW262.27 g/mol
LogP-0.87
Rot. Bonds3

About 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide

2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide (PubChem CID 155218183) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide
PubChem CID155218183
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC Name2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESNc1cccnc1CC(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C12H14N4O3/c13-7-2-1-5-14-9(7)6-11(18)15-8-3-4-10(17)16-12(8)19/h1-2,5,8H,3-4,6,13H2,(H,15,18)(H,16,17,19)
InChIKeyFWTLWWVRTKQIIH-UHFFFAOYSA-N
XLogP-0.87
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The IUPAC name of 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide (CID 155218183) is 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The canonical SMILES for 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide is Nc1cccnc1CC(=O)NC1CCC(=O)NC1=O.
What is the InChIKey of 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The InChIKey is FWTLWWVRTKQIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3/c13-7-2-1-5-14-9(7)6-11(18)15-8-3-4-10(17)16-12(8)19/h1-2,5,8H,3-4,6,13H2,(H,15,18)(H,16,17,19).
What are the key properties of 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide has a molecular weight of 262.27 g/mol, XLogP of -0.87, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2-pyridinyl)-N-(2,6-dioxopiperidin-3-yl)acetamide is sourced from PubChem (CID 155218183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).