1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone

C17H23N3O4 — CID 74237629

IUPAC1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone
SMILESO=C(COc1ccccc1)N1CCN(C(=O)C2CNCCO2)CC1
InChIInChI=1S/C17H23N3O4/c21-16(13-24-14-4-2-1-3-5-14)19-7-9-20(10-8-19)17(22)15-12-18-6-11-23-15/h1-5,15,18H,6-13H2
InChIKeyZHWJTYVTYWZQJL-UHFFFAOYSA-N
MW333.39 g/mol
LogP-0.28
Rot. Bonds4

About 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone

1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone (PubChem CID 74237629) has the molecular formula C17H23N3O4 and a molecular weight of 333.39 g/mol. Its IUPAC name is 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone.

Molecular Properties

Compound Name1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone
PubChem CID74237629
Molecular FormulaC17H23N3O4
Molecular Weight333.39 g/mol
Exact Mass333.17
IUPAC Name1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone
SMILESO=C(COc1ccccc1)N1CCN(C(=O)C2CNCCO2)CC1
InChIInChI=1S/C17H23N3O4/c21-16(13-24-14-4-2-1-3-5-14)19-7-9-20(10-8-19)17(22)15-12-18-6-11-23-15/h1-5,15,18H,6-13H2
InChIKeyZHWJTYVTYWZQJL-UHFFFAOYSA-N
XLogP-0.28
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(aziridin-1-yl)-2-phenoxyethanone
CID 3053844
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-2-carboxamide
CID 119713878
[4-(benzenesulfonyl)piperazin-1-yl]-morpholin-2-ylmethanone
CID 119678332
3-(4-methoxyphenyl)-1-[4-(morpholine-2-carbonyl)piperazin-1-yl]propan-1-one
CID 119754722
1-[4-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]piperidin-1-yl]-2-phenoxyethanone
CID 55630806
[(2R)-morpholin-2-yl]-[4-(4-phenylpyrimidin-2-yl)piperazin-1-yl]methanone
CID 125178265
[1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride
CID 119699768
1-[4-(2-phenoxyacetyl)piperazin-1-yl]-2-phenylethanone
CID 695003
2-(4-ethoxyphenoxy)-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethanone
CID 108536689
1-[4-(cyclopentanecarbonyl)-1,4-diazepan-1-yl]-2-phenoxyethanone
CID 110797836
2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-morpholin-4-ylethanone
CID 119834280
1-[1-(2-phenoxyacetyl)piperidine-4-carbonyl]piperidine-4-carboxylic acid
CID 119166473

Frequently Asked Questions

What is the IUPAC name of 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone?
The IUPAC name of 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone (CID 74237629) is 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone.
What is the SMILES notation for 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone?
The canonical SMILES for 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone is O=C(COc1ccccc1)N1CCN(C(=O)C2CNCCO2)CC1.
What is the InChIKey of 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone?
The InChIKey is ZHWJTYVTYWZQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4/c21-16(13-24-14-4-2-1-3-5-14)19-7-9-20(10-8-19)17(22)15-12-18-6-11-23-15/h1-5,15,18H,6-13H2.
What are the key properties of 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone?
1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone has a molecular weight of 333.39 g/mol, XLogP of -0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone is sourced from PubChem (CID 74237629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).