4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide

C18H24N4O4 — CID 91909864

IUPAC4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide
SMILESCOCCOCc1nc(C2CCN(C(=O)Nc3ccccc3)CC2)no1
InChIInChI=1S/C18H24N4O4/c1-24-11-12-25-13-16-20-17(21-26-16)14-7-9-22(10-8-14)18(23)19-15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H,19,23)
InChIKeyHWVTYDCBCCVIOI-UHFFFAOYSA-N
MW360.41 g/mol
LogP2.64
Rot. Bonds7

About 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide

4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide (PubChem CID 91909864) has the molecular formula C18H24N4O4 and a molecular weight of 360.41 g/mol. Its IUPAC name is 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide
PubChem CID91909864
Molecular FormulaC18H24N4O4
Molecular Weight360.41 g/mol
Exact Mass360.18
IUPAC Name4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide
SMILESCOCCOCc1nc(C2CCN(C(=O)Nc3ccccc3)CC2)no1
InChIInChI=1S/C18H24N4O4/c1-24-11-12-25-13-16-20-17(21-26-16)14-7-9-22(10-8-14)18(23)19-15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H,19,23)
InChIKeyHWVTYDCBCCVIOI-UHFFFAOYSA-N
XLogP2.64
TPSA89.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-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 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide (CID 91909864) is 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide is COCCOCc1nc(C2CCN(C(=O)Nc3ccccc3)CC2)no1.
What is the InChIKey of 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide?
The InChIKey is HWVTYDCBCCVIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O4/c1-24-11-12-25-13-16-20-17(21-26-16)14-7-9-22(10-8-14)18(23)19-15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H,19,23).
What are the key properties of 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide?
4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide has a molecular weight of 360.41 g/mol, XLogP of 2.64, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(2-methoxyethoxymethyl)-1,2,4-oxadiazol-3-yl]-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 91909864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).