N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide

C19H26N4O3 — CID 171786638

IUPACN-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCC(C)N1CCC(c2ccc(C(=O)NC3CCC(=O)NC3=O)nc2)CC1
InChIInChI=1S/C19H26N4O3/c1-12(2)23-9-7-13(8-10-23)14-3-4-15(20-11-14)18(25)21-16-5-6-17(24)22-19(16)26/h3-4,11-13,16H,5-10H2,1-2H3,(H,21,25)(H,22,24,26)
InChIKeyPIFZMFUARRXAAY-UHFFFAOYSA-N
MW358.44 g/mol
LogP1.20
Rot. Bonds4

About N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide

N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide (PubChem CID 171786638) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide
PubChem CID171786638
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCC(C)N1CCC(c2ccc(C(=O)NC3CCC(=O)NC3=O)nc2)CC1
InChIInChI=1S/C19H26N4O3/c1-12(2)23-9-7-13(8-10-23)14-3-4-15(20-11-14)18(25)21-16-5-6-17(24)22-19(16)26/h3-4,11-13,16H,5-10H2,1-2H3,(H,21,25)(H,22,24,26)
InChIKeyPIFZMFUARRXAAY-UHFFFAOYSA-N
XLogP1.20
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 51.20
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 N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide (CID 171786638) is N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide is CC(C)N1CCC(c2ccc(C(=O)NC3CCC(=O)NC3=O)nc2)CC1.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide?
The InChIKey is PIFZMFUARRXAAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c1-12(2)23-9-7-13(8-10-23)14-3-4-15(20-11-14)18(25)21-16-5-6-17(24)22-19(16)26/h3-4,11-13,16H,5-10H2,1-2H3,(H,21,25)(H,22,24,26).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide?
N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide has a molecular weight of 358.44 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 171786638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).