cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone

C20H25FN2O3 — CID 134044230

IUPACcyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCC(C(=O)N2CCOC(c3ccc(F)cc3)C2)CC1
InChIInChI=1S/C20H25FN2O3/c21-17-5-3-14(4-6-17)18-13-23(11-12-26-18)20(25)16-7-9-22(10-8-16)19(24)15-1-2-15/h3-6,15-16,18H,1-2,7-13H2
InChIKeyZSGZIECIANDEAJ-UHFFFAOYSA-N
MW360.43 g/mol
LogP2.37
Rot. Bonds3

About cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone

cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone (PubChem CID 134044230) has the molecular formula C20H25FN2O3 and a molecular weight of 360.43 g/mol. Its IUPAC name is cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone
PubChem CID134044230
Molecular FormulaC20H25FN2O3
Molecular Weight360.43 g/mol
Exact Mass360.18
IUPAC Namecyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCC(C(=O)N2CCOC(c3ccc(F)cc3)C2)CC1
InChIInChI=1S/C20H25FN2O3/c21-17-5-3-14(4-6-17)18-13-23(11-12-26-18)20(25)16-7-9-22(10-8-16)19(24)15-1-2-15/h3-6,15-16,18H,1-2,7-13H2
InChIKeyZSGZIECIANDEAJ-UHFFFAOYSA-N
XLogP2.37
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.43
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R)-1,1-dioxothiolan-3-yl]-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]methanone
CID 94005516
[2-(4-fluorophenyl)morpholin-4-yl]-piperidin-3-ylmethanone
CID 60963365
1-[(3S)-3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]ethanone
CID 94037830
(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one
CID 94159203
(4R)-1-cyclopropyl-4-[(2S)-2-(4-fluorophenyl)morpholine-4-carbonyl]pyrrolidin-2-one
CID 95569973
[2-(4-fluorophenyl)morpholin-4-yl]-[(2S,4S)-2-methylpiperidin-4-yl]methanone;hydrochloride
CID 120615823
2-[2-(4-fluorophenyl)morpholine-4-carbonyl]cyclopropane-1-carboxylic acid
CID 60949473
4-[2-(4-bromophenyl)morpholine-4-carbonyl]cyclohexane-1-carboxylic acid
CID 120673076
[2-(4-fluorophenyl)morpholin-4-yl]-[(2S)-pyrrolidin-2-yl]methanone;hydrochloride
CID 119112320
(4R)-1-(cyclopropylmethyl)-4-[(2S)-2-(4-fluorophenyl)morpholine-4-carbonyl]pyrrolidin-2-one
CID 94098725
1-[4-(2-pyridin-4-ylmorpholine-4-carbonyl)piperidin-1-yl]ethanone
CID 110102575
[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone
CID 110327062

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone (CID 134044230) is cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone is O=C(C1CC1)N1CCC(C(=O)N2CCOC(c3ccc(F)cc3)C2)CC1.
What is the InChIKey of cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone?
The InChIKey is ZSGZIECIANDEAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FN2O3/c21-17-5-3-14(4-6-17)18-13-23(11-12-26-18)20(25)16-7-9-22(10-8-16)19(24)15-1-2-15/h3-6,15-16,18H,1-2,7-13H2.
What are the key properties of cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone?
cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone has a molecular weight of 360.43 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone is sourced from PubChem (CID 134044230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).