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

C15H18FN3O2 — CID 98723473

IUPAC(2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
SMILESCc1nnc([C@@H](C)N2CCO[C@@H](c3ccc(F)cc3)C2)o1
InChIInChI=1S/C15H18FN3O2/c1-10(15-18-17-11(2)21-15)19-7-8-20-14(9-19)12-3-5-13(16)6-4-12/h3-6,10,14H,7-9H2,1-2H3/t10-,14-/m1/s1
InChIKeyZEWGJAGGXSPTFV-QMTHXVAHSA-N
MW291.33 g/mol
LogP2.65
Rot. Bonds3

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

(2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine (PubChem CID 98723473) has the molecular formula C15H18FN3O2 and a molecular weight of 291.33 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
PubChem CID98723473
Molecular FormulaC15H18FN3O2
Molecular Weight291.33 g/mol
Exact Mass291.14
IUPAC Name(2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
SMILESCc1nnc([C@@H](C)N2CCO[C@@H](c3ccc(F)cc3)C2)o1
InChIInChI=1S/C15H18FN3O2/c1-10(15-18-17-11(2)21-15)19-7-8-20-14(9-19)12-3-5-13(16)6-4-12/h3-6,10,14H,7-9H2,1-2H3/t10-,14-/m1/s1
InChIKeyZEWGJAGGXSPTFV-QMTHXVAHSA-N
XLogP2.65
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-(4-fluorophenyl)-4-[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
CID 36875201
(2S)-2-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine
CID 67352997
(2R)-2-(4-fluorophenyl)-4-[(1S)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethyl]morpholine
CID 51671941
(2R)-2-(4-fluorophenyl)-4-methylmorpholine
CID 67355003
(2R)-2-phenyl-4-[(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
CID 94820850
(2R)-2-cyclohexyl-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
CID 129345080
N-[(1R)-1-[4-[1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethyl]phenyl]ethyl]methanesulfonamide;hydrochloride
CID 162313172
(2S)-2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
CID 95274096
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 46571508
4-propan-2-yl-2-pyridin-4-ylmorpholine
CID 176665996
2-(4-bromophenyl)-4-propan-2-ylmorpholine
CID 82184636
(2R)-4-tert-butyl-2-(4-fluorophenyl)morpholine
CID 67354572

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
The IUPAC name of (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine (CID 98723473) is (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine.
What is the SMILES notation for (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
The canonical SMILES for (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine is Cc1nnc([C@@H](C)N2CCO[C@@H](c3ccc(F)cc3)C2)o1.
What is the InChIKey of (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
The InChIKey is ZEWGJAGGXSPTFV-QMTHXVAHSA-N. The full InChI is InChI=1S/C15H18FN3O2/c1-10(15-18-17-11(2)21-15)19-7-8-20-14(9-19)12-3-5-13(16)6-4-12/h3-6,10,14H,7-9H2,1-2H3/t10-,14-/m1/s1.
What are the key properties of (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
(2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine has a molecular weight of 291.33 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenyl)-4-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine is sourced from PubChem (CID 98723473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).