6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one

C15H20FN3O2 — CID 171700802

IUPAC6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one
SMILESO=C1COC(CN2CCN(c3ccccc3F)CC2)CN1
InChIInChI=1S/C15H20FN3O2/c16-13-3-1-2-4-14(13)19-7-5-18(6-8-19)10-12-9-17-15(20)11-21-12/h1-4,12H,5-11H2,(H,17,20)
InChIKeyHXGPNXHAUHBFAR-UHFFFAOYSA-N
MW293.34 g/mol
LogP0.46
Rot. Bonds3

About 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one

6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one (PubChem CID 171700802) has the molecular formula C15H20FN3O2 and a molecular weight of 293.34 g/mol. Its IUPAC name is 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one.

Molecular Properties

Compound Name6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one
PubChem CID171700802
Molecular FormulaC15H20FN3O2
Molecular Weight293.34 g/mol
Exact Mass293.15
IUPAC Name6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one
SMILESO=C1COC(CN2CCN(c3ccccc3F)CC2)CN1
InChIInChI=1S/C15H20FN3O2/c16-13-3-1-2-4-14(13)19-7-5-18(6-8-19)10-12-9-17-15(20)11-21-12/h1-4,12H,5-11H2,(H,17,20)
InChIKeyHXGPNXHAUHBFAR-UHFFFAOYSA-N
XLogP0.46
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
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

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Related Compounds

2-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-2,3-dihydrochromen-4-one
CID 59178057
1-(2-fluorophenyl)-4-[(3-methylpyrrolidin-2-yl)methyl]piperazine
CID 102775666
1-(2-fluorophenyl)-4-[[(3S)-1-methylpiperidin-3-yl]methyl]piperazine
CID 97185936
1-(2-fluorophenyl)-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine
CID 93355113
6-[[4-(4-pyrrolidin-1-ylquinazolin-6-yl)piperazin-1-yl]methyl]morpholin-3-one
CID 126896200
4-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]cyclopent-2-en-1-amine
CID 79207543
1-[2-(azetidin-3-yl)propyl]-4-(2-fluorophenyl)piperazine
CID 116679480
(4S)-4-[4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one
CID 42558865
4-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]pyrazolidine-3,5-dione
CID 110703277
2-cyclopropyl-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-2-amine
CID 60918844
(4-ethylpiperazin-1-yl)-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]cyclopropyl]methanone
CID 109134358
1-[[1-(bromomethyl)cyclopropyl]methyl]-4-(2-fluorophenyl)piperazine
CID 65013429

Frequently Asked Questions

What is the IUPAC name of 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one?
The IUPAC name of 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one (CID 171700802) is 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one.
What is the SMILES notation for 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one?
The canonical SMILES for 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one is O=C1COC(CN2CCN(c3ccccc3F)CC2)CN1.
What is the InChIKey of 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one?
The InChIKey is HXGPNXHAUHBFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3O2/c16-13-3-1-2-4-14(13)19-7-5-18(6-8-19)10-12-9-17-15(20)11-21-12/h1-4,12H,5-11H2,(H,17,20).
What are the key properties of 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one?
6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one has a molecular weight of 293.34 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]morpholin-3-one is sourced from PubChem (CID 171700802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).