[4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone

C15H20FN3O2 — CID 124513191

IUPAC[4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone
SMILESO=C([C@@H]1COCCN1)N1CCN(c2ccccc2F)CC1
InChIInChI=1S/C15H20FN3O2/c16-12-3-1-2-4-14(12)18-6-8-19(9-7-18)15(20)13-11-21-10-5-17-13/h1-4,13,17H,5-11H2/t13-/m0/s1
InChIKeyJJFNNKXIEHXNLN-ZDUSSCGKSA-N
MW293.34 g/mol
LogP0.46
Rot. Bonds2

About [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone

[4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone (PubChem CID 124513191) has the molecular formula C15H20FN3O2 and a molecular weight of 293.34 g/mol. Its IUPAC name is [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone.

Molecular Properties

Compound Name[4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone
PubChem CID124513191
Molecular FormulaC15H20FN3O2
Molecular Weight293.34 g/mol
Exact Mass293.15
IUPAC Name[4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone
SMILESO=C([C@@H]1COCCN1)N1CCN(c2ccccc2F)CC1
InChIInChI=1S/C15H20FN3O2/c16-12-3-1-2-4-14(12)18-6-8-19(9-7-18)15(20)13-11-21-10-5-17-13/h1-4,13,17H,5-11H2/t13-/m0/s1
InChIKeyJJFNNKXIEHXNLN-ZDUSSCGKSA-N
XLogP0.46
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(2,5-difluorophenyl)piperazin-1-yl]-morpholin-3-ylmethanone
CID 119887859
2-(2-fluorophenyl)-1-[4-(morpholine-3-carbonyl)piperazin-1-yl]ethanone;hydrochloride
CID 119754847
[4-(4-fluoro-2-methoxyphenyl)piperazin-1-yl]-[(3R)-morpholin-3-yl]methanone
CID 124686188
[4-(2-fluorophenyl)piperazin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120937671
[4-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-morpholin-3-ylmethanone
CID 119854290
(4-aminooxolan-3-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 66240445
[4-(4-fluorobenzoyl)-1,4-diazepan-1-yl]-morpholin-3-ylmethanone;hydrochloride
CID 119710339
[4-(3-methoxyphenyl)piperazin-1-yl]-morpholin-3-ylmethanone
CID 119829383
[4-(2-fluorophenyl)piperazin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 40572583
cyclopropyl-[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl]methanone
CID 34228816
[4-(2,6-dichlorobenzoyl)piperazin-1-yl]-morpholin-3-ylmethanone;hydrochloride
CID 119743440
2-adamantyl-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 51191557

Frequently Asked Questions

What is the IUPAC name of [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone?
The IUPAC name of [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone (CID 124513191) is [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone.
What is the SMILES notation for [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone?
The canonical SMILES for [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone is O=C([C@@H]1COCCN1)N1CCN(c2ccccc2F)CC1.
What is the InChIKey of [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone?
The InChIKey is JJFNNKXIEHXNLN-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H20FN3O2/c16-12-3-1-2-4-14(12)18-6-8-19(9-7-18)15(20)13-11-21-10-5-17-13/h1-4,13,17H,5-11H2/t13-/m0/s1.
What are the key properties of [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone?
[4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone has a molecular weight of 293.34 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-fluorophenyl)piperazin-1-yl]-[(3S)-morpholin-3-yl]methanone is sourced from PubChem (CID 124513191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).