3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide

C18H29N5O4 — CID 51049081

IUPAC3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide
SMILESCC1(C)CC(NC(=O)c2nc(CC(=O)N3CCOCC3)no2)CC(C)(C)N1
InChIInChI=1S/C18H29N5O4/c1-17(2)10-12(11-18(3,4)22-17)19-15(25)16-20-13(21-27-16)9-14(24)23-5-7-26-8-6-23/h12,22H,5-11H2,1-4H3,(H,19,25)
InChIKeyRUFUPKQGSBRIDW-UHFFFAOYSA-N
MW379.46 g/mol
LogP0.51
Rot. Bonds4

About 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide

3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide (PubChem CID 51049081) has the molecular formula C18H29N5O4 and a molecular weight of 379.46 g/mol. Its IUPAC name is 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide.

Molecular Properties

Compound Name3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide
PubChem CID51049081
Molecular FormulaC18H29N5O4
Molecular Weight379.46 g/mol
Exact Mass379.22
IUPAC Name3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide
SMILESCC1(C)CC(NC(=O)c2nc(CC(=O)N3CCOCC3)no2)CC(C)(C)N1
InChIInChI=1S/C18H29N5O4/c1-17(2)10-12(11-18(3,4)22-17)19-15(25)16-20-13(21-27-16)9-14(24)23-5-7-26-8-6-23/h12,22H,5-11H2,1-4H3,(H,19,25)
InChIKeyRUFUPKQGSBRIDW-UHFFFAOYSA-N
XLogP0.51
TPSA109.59 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(3-methoxypropyl)-3-(2-morpholin-4-yl-2-oxoethyl)-1,2,4-oxadiazole-5-carboxamide
CID 51049292
3-ethyl-N-[1-(oxan-4-yl)piperidin-4-yl]-1,2,4-oxadiazole-5-carboxamide
CID 136569802
2-chloro-5-morpholin-4-ylsulfonyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 2343813
ethane;N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 178170769
1-(3-morpholin-4-ylpropyl)-3-(2,2,6,6-tetramethylpiperidin-4-yl)thiourea
CID 8668510
N-(2,2,6,6-tetramethylpiperidin-4-yl)-2H-triazole-4-carboxamide
CID 74244989
4-(2-morpholin-4-ylphenoxy)-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 57344971
5-phenyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2-oxazole-3-carboxamide
CID 5253507
2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone
CID 124802829
1-morpholin-4-yl-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propan-1-one
CID 103991059
1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3-(2,2,6,6-tetramethylpiperidin-4-yl)urea
CID 154834109
3-(2-anilino-2-oxoethyl)-N-(2-morpholin-4-ylethyl)-1,2,4-oxadiazole-5-carboxamide
CID 39036188

Frequently Asked Questions

What is the IUPAC name of 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide?
The IUPAC name of 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide (CID 51049081) is 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide.
What is the SMILES notation for 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide?
The canonical SMILES for 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide is CC1(C)CC(NC(=O)c2nc(CC(=O)N3CCOCC3)no2)CC(C)(C)N1.
What is the InChIKey of 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide?
The InChIKey is RUFUPKQGSBRIDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N5O4/c1-17(2)10-12(11-18(3,4)22-17)19-15(25)16-20-13(21-27-16)9-14(24)23-5-7-26-8-6-23/h12,22H,5-11H2,1-4H3,(H,19,25).
What are the key properties of 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide?
3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 0.51, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-morpholin-4-yl-2-oxoethyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide is sourced from PubChem (CID 51049081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).