(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one

C16H19FN2O3 — CID 94159203

IUPAC(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one
SMILESO=C1CC[C@H](C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)CN1
InChIInChI=1S/C16H19FN2O3/c17-13-4-1-11(2-5-13)14-10-19(7-8-22-14)16(21)12-3-6-15(20)18-9-12/h1-2,4-5,12,14H,3,6-10H2,(H,18,20)/t12-,14-/m0/s1
InChIKeyHURXYEKAYPVSEL-JSGCOSHPSA-N
MW306.34 g/mol
LogP1.25
Rot. Bonds2

About (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one

(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one (PubChem CID 94159203) has the molecular formula C16H19FN2O3 and a molecular weight of 306.34 g/mol. Its IUPAC name is (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one.

Molecular Properties

Compound Name(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one
PubChem CID94159203
Molecular FormulaC16H19FN2O3
Molecular Weight306.34 g/mol
Exact Mass306.14
IUPAC Name(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one
SMILESO=C1CC[C@H](C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)CN1
InChIInChI=1S/C16H19FN2O3/c17-13-4-1-11(2-5-13)14-10-19(7-8-22-14)16(21)12-3-6-15(20)18-9-12/h1-2,4-5,12,14H,3,6-10H2,(H,18,20)/t12-,14-/m0/s1
InChIKeyHURXYEKAYPVSEL-JSGCOSHPSA-N
XLogP1.25
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone
CID 134044230
[2-(4-fluorophenyl)morpholin-4-yl]-piperidin-3-ylmethanone
CID 60963365
(4R)-1-cyclopropyl-4-[(2S)-2-(4-fluorophenyl)morpholine-4-carbonyl]pyrrolidin-2-one
CID 95569973
(4R)-1-(cyclopropylmethyl)-4-[(2S)-2-(4-fluorophenyl)morpholine-4-carbonyl]pyrrolidin-2-one
CID 94098725
[(3R)-1,1-dioxothiolan-3-yl]-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]methanone
CID 94005516
1-[(3S)-3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]ethanone
CID 94037830
2-[2-(4-fluorophenyl)morpholine-4-carbonyl]cyclopropane-1-carboxylic acid
CID 60949473
[2-(4-fluorophenyl)morpholin-4-yl]-[(2S,4S)-2-methylpiperidin-4-yl]methanone;hydrochloride
CID 120615823
5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one
CID 81484363
[2-(4-fluorophenyl)morpholin-4-yl]-[(2S)-pyrrolidin-2-yl]methanone;hydrochloride
CID 119112320
[2-(4-chlorophenyl)morpholin-4-yl]-pyrrolidin-3-ylmethanone
CID 63005450
methyl 2-[4-(6-oxopiperidine-3-carbonyl)morpholin-2-yl]acetate
CID 79807210

Frequently Asked Questions

What is the IUPAC name of (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one?
The IUPAC name of (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one (CID 94159203) is (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one.
What is the SMILES notation for (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one?
The canonical SMILES for (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one is O=C1CC[C@H](C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)CN1.
What is the InChIKey of (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one?
The InChIKey is HURXYEKAYPVSEL-JSGCOSHPSA-N. The full InChI is InChI=1S/C16H19FN2O3/c17-13-4-1-11(2-5-13)14-10-19(7-8-22-14)16(21)12-3-6-15(20)18-9-12/h1-2,4-5,12,14H,3,6-10H2,(H,18,20)/t12-,14-/m0/s1.
What are the key properties of (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one?
(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one has a molecular weight of 306.34 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one is sourced from PubChem (CID 94159203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).