[5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone

C20H24N6O4 — CID 128969070

IUPAC[5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone
SMILESO=C(c1cn[nH]c1C1CCCN(Cc2nc(-c3ccoc3)no2)C1)N1CCOCC1
InChIInChI=1S/C20H24N6O4/c27-20(26-5-8-28-9-6-26)16-10-21-23-18(16)14-2-1-4-25(11-14)12-17-22-19(24-30-17)15-3-7-29-13-15/h3,7,10,13-14H,1-2,4-6,8-9,11-12H2,(H,21,23)
InChIKeyWMLYRAMVEUVUIQ-UHFFFAOYSA-N
MW412.45 g/mol
LogP1.90
Rot. Bonds5

About [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone

[5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone (PubChem CID 128969070) has the molecular formula C20H24N6O4 and a molecular weight of 412.45 g/mol. Its IUPAC name is [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone
PubChem CID128969070
Molecular FormulaC20H24N6O4
Molecular Weight412.45 g/mol
Exact Mass412.19
IUPAC Name[5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone
SMILESO=C(c1cn[nH]c1C1CCCN(Cc2nc(-c3ccoc3)no2)C1)N1CCOCC1
InChIInChI=1S/C20H24N6O4/c27-20(26-5-8-28-9-6-26)16-10-21-23-18(16)14-2-1-4-25(11-14)12-17-22-19(24-30-17)15-3-7-29-13-15/h3,7,10,13-14H,1-2,4-6,8-9,11-12H2,(H,21,23)
InChIKeyWMLYRAMVEUVUIQ-UHFFFAOYSA-N
XLogP1.90
TPSA113.52 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.45
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone with MolForge

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Launch Full Analysis

Related Compounds

morpholin-4-yl-[5-[1-(quinolin-4-ylmethyl)piperidin-3-yl]-1H-pyrazol-4-yl]methanone
CID 110082993
[5-[1-[(5-fluoro-1-benzofuran-2-yl)methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone
CID 128993503
[5-[(3S)-1-[(5-fluoro-1-benzofuran-2-yl)methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone
CID 129324268
[(3S)-1-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 41305841
[(3R)-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 51728064
morpholin-4-yl-[5-[(3R)-piperidin-3-yl]-1H-pyrazol-4-yl]methanone
CID 98041423
1-[[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[2-(morpholine-4-carbonyl)phenyl]piperidine-3-carboxamide
CID 43932123
1-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-[2-(morpholine-4-carbonyl)phenyl]piperidine-3-carboxamide
CID 43934242
azepan-1-yl-[5-[1-[(2-propoxyphenyl)methyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanone
CID 110083021
[1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 43930302
(3-methylpiperidin-1-yl)-[1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]methanone
CID 43929304
(2S)-4-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]-2-phenylmorpholine
CID 95323433

Frequently Asked Questions

What is the IUPAC name of [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone (CID 128969070) is [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone is O=C(c1cn[nH]c1C1CCCN(Cc2nc(-c3ccoc3)no2)C1)N1CCOCC1.
What is the InChIKey of [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone?
The InChIKey is WMLYRAMVEUVUIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O4/c27-20(26-5-8-28-9-6-26)16-10-21-23-18(16)14-2-1-4-25(11-14)12-17-22-19(24-30-17)15-3-7-29-13-15/h3,7,10,13-14H,1-2,4-6,8-9,11-12H2,(H,21,23).
What are the key properties of [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone?
[5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone has a molecular weight of 412.45 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[1-[[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 128969070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).