1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide

C17H22N4O3 — CID 173154077

IUPAC1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide
SMILESCC1CCN(c2cccc(C3CC(=O)NC(=O)C3)n2)C(C(N)=O)C1
InChIInChI=1S/C17H22N4O3/c1-10-5-6-21(13(7-10)17(18)24)14-4-2-3-12(19-14)11-8-15(22)20-16(23)9-11/h2-4,10-11,13H,5-9H2,1H3,(H2,18,24)(H,20,22,23)
InChIKeyZLSWVMZJUVZREU-UHFFFAOYSA-N
MW330.39 g/mol
LogP0.69
Rot. Bonds3

About 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide

1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide (PubChem CID 173154077) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide
PubChem CID173154077
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide
SMILESCC1CCN(c2cccc(C3CC(=O)NC(=O)C3)n2)C(C(N)=O)C1
InChIInChI=1S/C17H22N4O3/c1-10-5-6-21(13(7-10)17(18)24)14-4-2-3-12(19-14)11-8-15(22)20-16(23)9-11/h2-4,10-11,13H,5-9H2,1H3,(H2,18,24)(H,20,22,23)
InChIKeyZLSWVMZJUVZREU-UHFFFAOYSA-N
XLogP0.69
TPSA105.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 50.69
H-Bond Donors ≤ 52
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 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide?
The IUPAC name of 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide (CID 173154077) is 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide.
What is the SMILES notation for 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide?
The canonical SMILES for 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide is CC1CCN(c2cccc(C3CC(=O)NC(=O)C3)n2)C(C(N)=O)C1.
What is the InChIKey of 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide?
The InChIKey is ZLSWVMZJUVZREU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-10-5-6-21(13(7-10)17(18)24)14-4-2-3-12(19-14)11-8-15(22)20-16(23)9-11/h2-4,10-11,13H,5-9H2,1H3,(H2,18,24)(H,20,22,23).
What are the key properties of 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide?
1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2,6-dioxopiperidin-4-yl)-2-pyridinyl]-4-methylpiperidine-2-carboxamide is sourced from PubChem (CID 173154077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).