1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone

C19H34N4O2 — CID 57443141

IUPAC1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone
SMILESO=C(CN1CCC(N2CCOCC2)CC1)N1CCN(C2CCC2)CC1
InChIInChI=1S/C19H34N4O2/c24-19(23-10-8-21(9-11-23)17-2-1-3-17)16-20-6-4-18(5-7-20)22-12-14-25-15-13-22/h17-18H,1-16H2
InChIKeyAOTOSRKOXZVWCP-UHFFFAOYSA-N
MW350.51 g/mol
LogP0.48
Rot. Bonds4

About 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone

1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone (PubChem CID 57443141) has the molecular formula C19H34N4O2 and a molecular weight of 350.51 g/mol. Its IUPAC name is 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone
PubChem CID57443141
Molecular FormulaC19H34N4O2
Molecular Weight350.51 g/mol
Exact Mass350.27
IUPAC Name1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone
SMILESO=C(CN1CCC(N2CCOCC2)CC1)N1CCN(C2CCC2)CC1
InChIInChI=1S/C19H34N4O2/c24-19(23-10-8-21(9-11-23)17-2-1-3-17)16-20-6-4-18(5-7-20)22-12-14-25-15-13-22/h17-18H,1-16H2
InChIKeyAOTOSRKOXZVWCP-UHFFFAOYSA-N
XLogP0.48
TPSA39.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone?
The IUPAC name of 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone (CID 57443141) is 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone?
The canonical SMILES for 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone is O=C(CN1CCC(N2CCOCC2)CC1)N1CCN(C2CCC2)CC1.
What is the InChIKey of 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone?
The InChIKey is AOTOSRKOXZVWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O2/c24-19(23-10-8-21(9-11-23)17-2-1-3-17)16-20-6-4-18(5-7-20)22-12-14-25-15-13-22/h17-18H,1-16H2.
What are the key properties of 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone?
1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone has a molecular weight of 350.51 g/mol, XLogP of 0.48, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclobutylpiperazin-1-yl)-2-(4-morpholin-4-ylpiperidin-1-yl)ethanone is sourced from PubChem (CID 57443141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).