2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol

C11H22N2O — CID 65462860

IUPAC2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol
SMILESOCCN1CCN(CC2CCC2)CC1
InChIInChI=1S/C11H22N2O/c14-9-8-12-4-6-13(7-5-12)10-11-2-1-3-11/h11,14H,1-10H2
InChIKeyBTODJBHORZOSKI-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.40
Rot. Bonds4

About 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol

2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol (PubChem CID 65462860) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol
PubChem CID65462860
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol
SMILESOCCN1CCN(CC2CCC2)CC1
InChIInChI=1S/C11H22N2O/c14-9-8-12-4-6-13(7-5-12)10-11-2-1-3-11/h11,14H,1-10H2
InChIKeyBTODJBHORZOSKI-UHFFFAOYSA-N
XLogP0.40
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol 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 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol (CID 65462860) is 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol is OCCN1CCN(CC2CCC2)CC1.
What is the InChIKey of 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol?
The InChIKey is BTODJBHORZOSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c14-9-8-12-4-6-13(7-5-12)10-11-2-1-3-11/h11,14H,1-10H2.
What are the key properties of 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol?
2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol has a molecular weight of 198.31 g/mol, XLogP of 0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclobutylmethyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 65462860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).