ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate

C12H24N2O3 — CID 110290231

IUPACethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate
SMILESCCOC(=O)N1CC(C)N(CCOC)C(C)C1
InChIInChI=1S/C12H24N2O3/c1-5-17-12(15)13-8-10(2)14(6-7-16-4)11(3)9-13/h10-11H,5-9H2,1-4H3
InChIKeyZTEZUVHNIPLDGG-UHFFFAOYSA-N
MW244.33 g/mol
LogP1.18
Rot. Bonds4

About ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate

ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate (PubChem CID 110290231) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate
PubChem CID110290231
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Nameethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate
SMILESCCOC(=O)N1CC(C)N(CCOC)C(C)C1
InChIInChI=1S/C12H24N2O3/c1-5-17-12(15)13-8-10(2)14(6-7-16-4)11(3)9-13/h10-11H,5-9H2,1-4H3
InChIKeyZTEZUVHNIPLDGG-UHFFFAOYSA-N
XLogP1.18
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate 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

diethyl 2,6-dimethylpiperazine-1,4-dicarboxylate
CID 121013120
ethyl 4-benzyl-3,5-dimethylpiperazine-1-carboxylate
CID 110393902
phenyl 4-(3-methoxypropyl)-3,5-dimethylpiperazine-1-carboxylate
CID 110413023
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone
CID 110629122
(2-chlorophenyl)-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]methanone
CID 110290214
4-(2-methoxyethyl)-3,5-dimethyl-N-phenylpiperazine-1-carboxamide
CID 110290209
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-3,3-diphenylpropan-1-one
CID 110290192
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-methyl-3-phenylpropan-1-one
CID 110354446
3-(4-fluorophenyl)-1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]propan-1-one
CID 110629087
1-[4-(2-methoxyethyl)-3,5-dimethylpiperazin-1-yl]-2-(2-methoxyphenoxy)ethanone
CID 110290223
ethyl 1-(2-methoxyethyl)aziridine-2-carboxylate
CID 102511677
ethyl (2R)-2-methylaziridine-1-carboxylate
CID 129364107

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate?
The IUPAC name of ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate (CID 110290231) is ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate.
What is the SMILES notation for ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate?
The canonical SMILES for ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate is CCOC(=O)N1CC(C)N(CCOC)C(C)C1.
What is the InChIKey of ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate?
The InChIKey is ZTEZUVHNIPLDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-5-17-12(15)13-8-10(2)14(6-7-16-4)11(3)9-13/h10-11H,5-9H2,1-4H3.
What are the key properties of ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate?
ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate has a molecular weight of 244.33 g/mol, XLogP of 1.18, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(2-methoxyethyl)-3,5-dimethylpiperazine-1-carboxylate is sourced from PubChem (CID 110290231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).