1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone

C15H25N3O3 — CID 110629122

IUPAC1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
SMILESCOCCN1C(C)CN(C(=O)Cc2cc(C)on2)CC1C
InChIInChI=1S/C15H25N3O3/c1-11-9-17(10-12(2)18(11)5-6-20-4)15(19)8-14-7-13(3)21-16-14/h7,11-12H,5-6,8-10H2,1-4H3
InChIKeyVWNHBSHBYIZDPN-UHFFFAOYSA-N
MW295.38 g/mol
LogP1.09
Rot. Bonds5

About 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone

1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone (PubChem CID 110629122) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone.

Molecular Properties

Compound Name1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
PubChem CID110629122
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
SMILESCOCCN1C(C)CN(C(=O)Cc2cc(C)on2)CC1C
InChIInChI=1S/C15H25N3O3/c1-11-9-17(10-12(2)18(11)5-6-20-4)15(19)8-14-7-13(3)21-16-14/h7,11-12H,5-6,8-10H2,1-4H3
InChIKeyVWNHBSHBYIZDPN-UHFFFAOYSA-N
XLogP1.09
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(5-methyl-1,2-oxazol-3-yl)acetyl]pyrrolidine-3-carboxylic acid
CID 119354480
2-(3-fluorophenyl)-1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]ethanone
CID 110662498
ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate
CID 110290231
1-[2-(5-methyl-1,2-oxazol-3-yl)acetyl]piperidine-4-carboxylic acid
CID 110836609
1-[(3S,5S)-4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-1-one
CID 97092772
2-[2-(2-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]-1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]ethanone
CID 110354437
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-3,3-diphenylpropan-1-one
CID 110290192
1-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-(5-methyl-1,2-oxazol-3-yl)ethanone;hydrochloride
CID 119635911
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-4-(4-methoxyphenyl)butane-1,4-dione
CID 110629105
2-(4-fluorophenyl)-1-[4-(3-methoxypropyl)-3,5-dimethylpiperazin-1-yl]ethanone
CID 110412995
2-(3-fluorophenyl)-1-[4-(3-methoxypropyl)-3,5-dimethylpiperazin-1-yl]ethanone
CID 110662541
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-3-(4-methoxyphenyl)butan-1-one
CID 110308401

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The IUPAC name of 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone (CID 110629122) is 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone.
What is the SMILES notation for 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The canonical SMILES for 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone is COCCN1C(C)CN(C(=O)Cc2cc(C)on2)CC1C.
What is the InChIKey of 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
The InChIKey is VWNHBSHBYIZDPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-11-9-17(10-12(2)18(11)5-6-20-4)15(19)8-14-7-13(3)21-16-14/h7,11-12H,5-6,8-10H2,1-4H3.
What are the key properties of 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone?
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone has a molecular weight of 295.38 g/mol, XLogP of 1.09, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone is sourced from PubChem (CID 110629122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).