cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone

C11H20N2O2 — CID 43416224

IUPACcyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
SMILESO=C(C1CCC1)N1CCN(CCO)CC1
InChIInChI=1S/C11H20N2O2/c14-9-8-12-4-6-13(7-5-12)11(15)10-2-1-3-10/h10,14H,1-9H2
InChIKeyBPRHVHXPVDHLLG-UHFFFAOYSA-N
MW212.29 g/mol
LogP-0.08
Rot. Bonds3

About cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone

cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (PubChem CID 43416224) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
PubChem CID43416224
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Namecyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
SMILESO=C(C1CCC1)N1CCN(CCO)CC1
InChIInChI=1S/C11H20N2O2/c14-9-8-12-4-6-13(7-5-12)11(15)10-2-1-3-10/h10,14H,1-9H2
InChIKeyBPRHVHXPVDHLLG-UHFFFAOYSA-N
XLogP-0.08
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
The IUPAC name of cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (CID 43416224) is cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone.
What is the SMILES notation for cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
The canonical SMILES for cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone is O=C(C1CCC1)N1CCN(CCO)CC1.
What is the InChIKey of cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
The InChIKey is BPRHVHXPVDHLLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c14-9-8-12-4-6-13(7-5-12)11(15)10-2-1-3-10/h10,14H,1-9H2.
What are the key properties of cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone has a molecular weight of 212.29 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 43416224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).