N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide

C19H24N4O5 — CID 90649353

IUPACN-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide
SMILESO=C(NCCc1noc(CO)n1)c1ccc(OCC(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H24N4O5/c24-12-17-21-16(22-28-17)8-9-20-19(26)14-4-6-15(7-5-14)27-13-18(25)23-10-2-1-3-11-23/h4-7,24H,1-3,8-13H2,(H,20,26)
InChIKeyQLXHSFNANRSWSR-UHFFFAOYSA-N
MW388.42 g/mol
LogP0.93
Rot. Bonds8

About N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide

N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide (PubChem CID 90649353) has the molecular formula C19H24N4O5 and a molecular weight of 388.42 g/mol. Its IUPAC name is N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide.

Molecular Properties

Compound NameN-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide
PubChem CID90649353
Molecular FormulaC19H24N4O5
Molecular Weight388.42 g/mol
Exact Mass388.17
IUPAC NameN-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide
SMILESO=C(NCCc1noc(CO)n1)c1ccc(OCC(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H24N4O5/c24-12-17-21-16(22-28-17)8-9-20-19(26)14-4-6-15(7-5-14)27-13-18(25)23-10-2-1-3-11-23/h4-7,24H,1-3,8-13H2,(H,20,26)
InChIKeyQLXHSFNANRSWSR-UHFFFAOYSA-N
XLogP0.93
TPSA117.79 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide with MolForge

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Related Compounds

1-(azepan-1-yl)-2-[4-(5-butyl-1,2,4-oxadiazol-3-yl)phenoxy]ethanone
CID 60585567
4-(6-ethoxypyridazin-3-yl)-N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]benzamide
CID 122572326
2-(4-tert-butylphenoxy)-1-piperidin-1-ylethanone
CID 19169351
4-[2-(azocan-1-yl)-2-oxoethoxy]benzamide
CID 8566237
2-(4-fluorophenoxy)-1-[4-[[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]methoxy]piperidin-1-yl]ethanone
CID 163339057
1-(azocan-1-yl)-2-[4-(4-fluorobenzoyl)phenoxy]ethanone
CID 55397362
methyl 4-[2-(azetidin-1-yl)-2-oxoethoxy]benzoate
CID 60743515
2-[4-(methylamino)phenoxy]-1-piperidin-1-ylethanone
CID 54908646
4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]-N-(2-piperazin-1-ylethyl)benzamide
CID 119446462
2-[4-(hydroxymethyl)phenoxy]-1-pyrrolidin-1-ylethanone
CID 28561501
4-[2-(azepan-1-yl)-2-oxoethoxy]benzenecarbothioamide
CID 24689917
4-butoxy-N-[(5-propyl-1,2,4-oxadiazol-3-yl)methyl]benzamide
CID 5041101

Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The IUPAC name of N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide (CID 90649353) is N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide.
What is the SMILES notation for N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The canonical SMILES for N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide is O=C(NCCc1noc(CO)n1)c1ccc(OCC(=O)N2CCCCC2)cc1.
What is the InChIKey of N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
The InChIKey is QLXHSFNANRSWSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O5/c24-12-17-21-16(22-28-17)8-9-20-19(26)14-4-6-15(7-5-14)27-13-18(25)23-10-2-1-3-11-23/h4-7,24H,1-3,8-13H2,(H,20,26).
What are the key properties of N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide?
N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide has a molecular weight of 388.42 g/mol, XLogP of 0.93, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(hydroxymethyl)-1,2,4-oxadiazol-3-yl]ethyl]-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide is sourced from PubChem (CID 90649353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).