(2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine

C17H23N3O2 — CID 94806550

IUPAC(2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
SMILESCCCc1noc([C@H](C)N2CCO[C@H](c3ccccc3)C2)n1
InChIInChI=1S/C17H23N3O2/c1-3-7-16-18-17(22-19-16)13(2)20-10-11-21-15(12-20)14-8-5-4-6-9-14/h4-6,8-9,13,15H,3,7,10-12H2,1-2H3/t13-,15-/m0/s1
InChIKeyOWYAQIIQKBPHEW-ZFWWWQNUSA-N
MW301.39 g/mol
LogP3.16
Rot. Bonds5

About (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine

(2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine (PubChem CID 94806550) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine.

Molecular Properties

Compound Name(2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
PubChem CID94806550
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name(2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
SMILESCCCc1noc([C@H](C)N2CCO[C@H](c3ccccc3)C2)n1
InChIInChI=1S/C17H23N3O2/c1-3-7-16-18-17(22-19-16)13(2)20-10-11-21-15(12-20)14-8-5-4-6-9-14/h4-6,8-9,13,15H,3,7,10-12H2,1-2H3/t13-,15-/m0/s1
InChIKeyOWYAQIIQKBPHEW-ZFWWWQNUSA-N
XLogP3.16
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(4-fluorophenyl)-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
CID 51671941
2-(4-chlorophenyl)-4-[1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
CID 47054230
(2S)-2-(4-fluorophenyl)-4-[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
CID 36875201
2-(4-chlorophenyl)-4-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
CID 47054235
(3S)-1-[(1R)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-3-ol
CID 94000661
(2S)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
CID 129335547
2-[1-[(1R)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-4-yl]-1,3-benzoxazole
CID 95139617
(2R)-2-phenyl-4-[(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
CID 94820850
(3S)-1-[(1S)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]-N-phenylpyrrolidin-3-amine
CID 52872567
1-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-4-ol
CID 94000693
(2S)-2-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine
CID 67352997
5-[(1R)-1-(4-ethylpiperazin-1-yl)ethyl]-3-propyl-1,2,4-oxadiazole
CID 94000629

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine?
The IUPAC name of (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine (CID 94806550) is (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine.
What is the SMILES notation for (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine?
The canonical SMILES for (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine is CCCc1noc([C@H](C)N2CCO[C@H](c3ccccc3)C2)n1.
What is the InChIKey of (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine?
The InChIKey is OWYAQIIQKBPHEW-ZFWWWQNUSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-3-7-16-18-17(22-19-16)13(2)20-10-11-21-15(12-20)14-8-5-4-6-9-14/h4-6,8-9,13,15H,3,7,10-12H2,1-2H3/t13-,15-/m0/s1.
What are the key properties of (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine?
(2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine has a molecular weight of 301.39 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine is sourced from PubChem (CID 94806550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).