5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one

C15H24N4O3 — CID 72872779

IUPAC5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one
SMILESCc1noc(C2CCC(=O)N(CCCN3CCOCC3)C2)n1
InChIInChI=1S/C15H24N4O3/c1-12-16-15(22-17-12)13-3-4-14(20)19(11-13)6-2-5-18-7-9-21-10-8-18/h13H,2-11H2,1H3
InChIKeyGKDGLYHQODMURS-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.81
Rot. Bonds5

About 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one

5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one (PubChem CID 72872779) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one.

Molecular Properties

Compound Name5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one
PubChem CID72872779
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC Name5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one
SMILESCc1noc(C2CCC(=O)N(CCCN3CCOCC3)C2)n1
InChIInChI=1S/C15H24N4O3/c1-12-16-15(22-17-12)13-3-4-14(20)19(11-13)6-2-5-18-7-9-21-10-8-18/h13H,2-11H2,1H3
InChIKeyGKDGLYHQODMURS-UHFFFAOYSA-N
XLogP0.81
TPSA71.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-phenylethyl)piperidin-2-one
CID 72892822
(5S)-1-(cyclohexylmethyl)-5-[3-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-5-yl]piperidin-2-one
CID 97154324
(5R)-5-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-1-[3-(2-oxopyrrolidin-1-yl)propyl]piperidin-2-one
CID 97146889
(5S)-1-cyclopropyl-5-[3-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-5-yl]piperidin-2-one
CID 97143936
3-methyl-5-[(3R)-1-methylpyrrolidin-3-yl]-1,2,4-oxadiazole
CID 92845934
(5R)-1-(2-methoxyethyl)-5-[3-[(1-methylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-5-yl]piperidin-2-one
CID 97157056
1-[(3-methoxyphenyl)methyl]-5-[3-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-5-yl]piperidin-2-one
CID 72889204
4-chloro-1-(3-morpholin-4-ylpropyl)pyrrolidin-2-one
CID 168688552
(4R)-1-[2-(dimethylamino)ethyl]-4-[3-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one
CID 97455337
1-(2-methoxyethyl)-5-[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]piperidin-2-one
CID 72882973
(3R)-N-[2-(4-ethyl-1,3-thiazol-2-yl)ethyl]-1-(3-morpholin-4-ylpropyl)-6-oxopiperidine-3-carboxamide
CID 31015905
(3S)-N-[2-(4-ethyl-1,3-thiazol-2-yl)ethyl]-1-(3-morpholin-4-ylpropyl)-6-oxopiperidine-3-carboxamide
CID 31015907

Frequently Asked Questions

What is the IUPAC name of 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one?
The IUPAC name of 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one (CID 72872779) is 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one.
What is the SMILES notation for 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one?
The canonical SMILES for 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one is Cc1noc(C2CCC(=O)N(CCCN3CCOCC3)C2)n1.
What is the InChIKey of 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one?
The InChIKey is GKDGLYHQODMURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-12-16-15(22-17-12)13-3-4-14(20)19(11-13)6-2-5-18-7-9-21-10-8-18/h13H,2-11H2,1H3.
What are the key properties of 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one?
5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one has a molecular weight of 308.38 g/mol, XLogP of 0.81, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(3-morpholin-4-ylpropyl)piperidin-2-one is sourced from PubChem (CID 72872779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).