N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

C11H16N4O4 — CID 167884886

IUPACN,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCN(Cc1n[nH]c(=O)o1)C(=O)C1(C)CCCNC1=O
InChIInChI=1S/C11H16N4O4/c1-11(4-3-5-12-8(11)16)9(17)15(2)6-7-13-14-10(18)19-7/h3-6H2,1-2H3,(H,12,16)(H,14,18)
InChIKeyIZGNYLDKUDQQLR-UHFFFAOYSA-N
MW268.27 g/mol
LogP-0.76
Rot. Bonds3

About N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide (PubChem CID 167884886) has the molecular formula C11H16N4O4 and a molecular weight of 268.27 g/mol. Its IUPAC name is N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
PubChem CID167884886
Molecular FormulaC11H16N4O4
Molecular Weight268.27 g/mol
Exact Mass268.12
IUPAC NameN,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCN(Cc1n[nH]c(=O)o1)C(=O)C1(C)CCCNC1=O
InChIInChI=1S/C11H16N4O4/c1-11(4-3-5-12-8(11)16)9(17)15(2)6-7-13-14-10(18)19-7/h3-6H2,1-2H3,(H,12,16)(H,14,18)
InChIKeyIZGNYLDKUDQQLR-UHFFFAOYSA-N
XLogP-0.76
TPSA108.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide (CID 167884886) is N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide is CN(Cc1n[nH]c(=O)o1)C(=O)C1(C)CCCNC1=O.
What is the InChIKey of N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
The InChIKey is IZGNYLDKUDQQLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O4/c1-11(4-3-5-12-8(11)16)9(17)15(2)6-7-13-14-10(18)19-7/h3-6H2,1-2H3,(H,12,16)(H,14,18).
What are the key properties of N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide has a molecular weight of 268.27 g/mol, XLogP of -0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-2-oxo-N-[(2-oxo-3H-1,3,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 167884886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).