1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone

C15H19FN2O2 — CID 110708570

IUPAC1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone
SMILESO=C(COc1ccccc1F)N1CCN(C2CC2)CC1
InChIInChI=1S/C15H19FN2O2/c16-13-3-1-2-4-14(13)20-11-15(19)18-9-7-17(8-10-18)12-5-6-12/h1-4,12H,5-11H2
InChIKeyQCZQIMKLXBSQLA-UHFFFAOYSA-N
MW278.33 g/mol
LogP1.51
Rot. Bonds4

About 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone

1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone (PubChem CID 110708570) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone.

Molecular Properties

Compound Name1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone
PubChem CID110708570
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC Name1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone
SMILESO=C(COc1ccccc1F)N1CCN(C2CC2)CC1
InChIInChI=1S/C15H19FN2O2/c16-13-3-1-2-4-14(13)20-11-15(19)18-9-7-17(8-10-18)12-5-6-12/h1-4,12H,5-11H2
InChIKeyQCZQIMKLXBSQLA-UHFFFAOYSA-N
XLogP1.51
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluorophenoxy)-1-(3-piperazin-1-ylpyrrolidin-1-yl)ethanone
CID 120997580
1-(4-cyclopentylpiperazin-1-yl)-2-(2-nitrophenoxy)ethanone
CID 134020517
N-cyclopropyl-2-[4-[2-(2-fluorophenoxy)acetyl]piperazin-1-yl]acetamide
CID 51221112
5-[4-[2-(2-fluorophenoxy)acetyl]piperazine-1-carbonyl]pyrrolidin-2-one
CID 110804418
1-[(3S)-3-(aminomethyl)pyrrolidin-1-yl]-2-(2-fluorophenoxy)ethanone
CID 124611644
2-(2-fluorophenoxy)-1-[(3S)-3-(triazol-2-yl)pyrrolidin-1-yl]ethanone
CID 124727622
1-(2,2-difluoro-6-azaspiro[2.5]octan-6-yl)-2-(2-fluorophenoxy)ethanone
CID 131702362
1-(4-cyclopentylpiperazin-1-yl)-2-(2,3-dimethylphenoxy)ethanone
CID 18456277
(3S)-1-[2-(2-fluorophenoxy)acetyl]piperidine-3-carboxylic acid
CID 81125518
(2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate
CID 23885124
1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(2-fluorophenoxy)ethanone
CID 8867044
1-[4-[2-(difluoromethoxy)benzoyl]piperazin-1-yl]-2-(2-fluorophenoxy)ethanone
CID 55548613

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone?
The IUPAC name of 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone (CID 110708570) is 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone.
What is the SMILES notation for 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone?
The canonical SMILES for 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone is O=C(COc1ccccc1F)N1CCN(C2CC2)CC1.
What is the InChIKey of 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone?
The InChIKey is QCZQIMKLXBSQLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c16-13-3-1-2-4-14(13)20-11-15(19)18-9-7-17(8-10-18)12-5-6-12/h1-4,12H,5-11H2.
What are the key properties of 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone?
1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone has a molecular weight of 278.33 g/mol, XLogP of 1.51, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone is sourced from PubChem (CID 110708570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).