N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide

C17H20N4O4 — CID 29139309

IUPACN-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCc2noc(C(=O)N3CCCCC3)n2)cc1
InChIInChI=1S/C17H20N4O4/c1-12(22)18-13-5-7-14(8-6-13)24-11-15-19-16(25-20-15)17(23)21-9-3-2-4-10-21/h5-8H,2-4,9-11H2,1H3,(H,18,22)
InChIKeyHIFFQHZLQJPPEO-UHFFFAOYSA-N
MW344.37 g/mol
LogP2.23
Rot. Bonds5

About N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide

N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide (PubChem CID 29139309) has the molecular formula C17H20N4O4 and a molecular weight of 344.37 g/mol. Its IUPAC name is N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide
PubChem CID29139309
Molecular FormulaC17H20N4O4
Molecular Weight344.37 g/mol
Exact Mass344.15
IUPAC NameN-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCc2noc(C(=O)N3CCCCC3)n2)cc1
InChIInChI=1S/C17H20N4O4/c1-12(22)18-13-5-7-14(8-6-13)24-11-15-19-16(25-20-15)17(23)21-9-3-2-4-10-21/h5-8H,2-4,9-11H2,1H3,(H,18,22)
InChIKeyHIFFQHZLQJPPEO-UHFFFAOYSA-N
XLogP2.23
TPSA97.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide?
The IUPAC name of N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide (CID 29139309) is N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide?
The canonical SMILES for N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide is CC(=O)Nc1ccc(OCc2noc(C(=O)N3CCCCC3)n2)cc1.
What is the InChIKey of N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide?
The InChIKey is HIFFQHZLQJPPEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O4/c1-12(22)18-13-5-7-14(8-6-13)24-11-15-19-16(25-20-15)17(23)21-9-3-2-4-10-21/h5-8H,2-4,9-11H2,1H3,(H,18,22).
What are the key properties of N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide?
N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide has a molecular weight of 344.37 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[5-(piperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]phenyl]acetamide is sourced from PubChem (CID 29139309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).