N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide

C16H18N4O4 — CID 176705465

IUPACN-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide
SMILESO=C1CCN(c2ccc(C(=O)NC3CCC(=O)NC3=O)cn2)CC1
InChIInChI=1S/C16H18N4O4/c21-11-5-7-20(8-6-11)13-3-1-10(9-17-13)15(23)18-12-2-4-14(22)19-16(12)24/h1,3,9,12H,2,4-8H2,(H,18,23)(H,19,22,24)
InChIKeyODLLXZNHQUSGCV-UHFFFAOYSA-N
MW330.34 g/mol
LogP-0.21
Rot. Bonds3

About N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide

N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 176705465) has the molecular formula C16H18N4O4 and a molecular weight of 330.34 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide
PubChem CID176705465
Molecular FormulaC16H18N4O4
Molecular Weight330.34 g/mol
Exact Mass330.13
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide
SMILESO=C1CCN(c2ccc(C(=O)NC3CCC(=O)NC3=O)cn2)CC1
InChIInChI=1S/C16H18N4O4/c21-11-5-7-20(8-6-11)13-3-1-10(9-17-13)15(23)18-12-2-4-14(22)19-16(12)24/h1,3,9,12H,2,4-8H2,(H,18,23)(H,19,22,24)
InChIKeyODLLXZNHQUSGCV-UHFFFAOYSA-N
XLogP-0.21
TPSA108.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide (CID 176705465) is N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide is O=C1CCN(c2ccc(C(=O)NC3CCC(=O)NC3=O)cn2)CC1.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is ODLLXZNHQUSGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O4/c21-11-5-7-20(8-6-11)13-3-1-10(9-17-13)15(23)18-12-2-4-14(22)19-16(12)24/h1,3,9,12H,2,4-8H2,(H,18,23)(H,19,22,24).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide?
N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 330.34 g/mol, XLogP of -0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-6-(4-oxopiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 176705465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).