4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine

C17H22N4O3 — CID 154758374

IUPAC4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine
SMILESCOc1cnccc1-c1noc(C2COCCN2C2CCCC2)n1
InChIInChI=1S/C17H22N4O3/c1-22-15-10-18-7-6-13(15)16-19-17(24-20-16)14-11-23-9-8-21(14)12-4-2-3-5-12/h6-7,10,12,14H,2-5,8-9,11H2,1H3
InChIKeyKYXCDKHDZXHFSH-UHFFFAOYSA-N
MW330.39 g/mol
LogP2.46
Rot. Bonds4

About 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine

4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine (PubChem CID 154758374) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine.

Molecular Properties

Compound Name4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine
PubChem CID154758374
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine
SMILESCOc1cnccc1-c1noc(C2COCCN2C2CCCC2)n1
InChIInChI=1S/C17H22N4O3/c1-22-15-10-18-7-6-13(15)16-19-17(24-20-16)14-11-23-9-8-21(14)12-4-2-3-5-12/h6-7,10,12,14H,2-5,8-9,11H2,1H3
InChIKeyKYXCDKHDZXHFSH-UHFFFAOYSA-N
XLogP2.46
TPSA73.51 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

(3S)-4-cyclopentyl-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)morpholine
CID 100659561
(3S)-4-cyclopentyl-3-[3-(4-methylsulfonylphenyl)-1,2,4-oxadiazol-5-yl]morpholine
CID 100660221
4-cyclopentyl-3-[3-(2-propan-2-yloxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine
CID 136543155
[(2S)-2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 95057584
5-[(2R)-1-(oxan-4-yl)pyrrolidin-2-yl]-3-pyridin-4-yl-1,2,4-oxadiazole
CID 99611541
3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]oxan-4-amine
CID 106474338
3-[3-(4-chloro-2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]oxan-4-amine
CID 106819970
3-[3-(4-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine
CID 114876910
(2S)-N-cyclopentyl-2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carboxamide
CID 95057944
(2-methoxyphenyl)-[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methanone
CID 53039319
(2R)-N-cyclohexyl-2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carboxamide
CID 95057885
4-[(2-chloro-6-methoxyphenyl)methyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)morpholine
CID 126799625

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine?
The IUPAC name of 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine (CID 154758374) is 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine.
What is the SMILES notation for 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine?
The canonical SMILES for 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine is COc1cnccc1-c1noc(C2COCCN2C2CCCC2)n1.
What is the InChIKey of 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine?
The InChIKey is KYXCDKHDZXHFSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-22-15-10-18-7-6-13(15)16-19-17(24-20-16)14-11-23-9-8-21(14)12-4-2-3-5-12/h6-7,10,12,14H,2-5,8-9,11H2,1H3.
What are the key properties of 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine?
4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine has a molecular weight of 330.39 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-3-[3-(3-methoxy-4-pyridinyl)-1,2,4-oxadiazol-5-yl]morpholine is sourced from PubChem (CID 154758374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).