3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one

C14H26N2O2 — CID 43390851

IUPAC3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one
SMILESO=C(CCC1CCCC1)N1CCN(CCO)CC1
InChIInChI=1S/C14H26N2O2/c17-12-11-15-7-9-16(10-8-15)14(18)6-5-13-3-1-2-4-13/h13,17H,1-12H2
InChIKeyGFFVRIUIIKNIIR-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.09
Rot. Bonds5

About 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one

3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one (PubChem CID 43390851) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one.

Molecular Properties

Compound Name3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one
PubChem CID43390851
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one
SMILESO=C(CCC1CCCC1)N1CCN(CCO)CC1
InChIInChI=1S/C14H26N2O2/c17-12-11-15-7-9-16(10-8-15)14(18)6-5-13-3-1-2-4-13/h13,17H,1-12H2
InChIKeyGFFVRIUIIKNIIR-UHFFFAOYSA-N
XLogP1.09
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one?
The IUPAC name of 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one (CID 43390851) is 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one.
What is the SMILES notation for 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one?
The canonical SMILES for 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one is O=C(CCC1CCCC1)N1CCN(CCO)CC1.
What is the InChIKey of 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one?
The InChIKey is GFFVRIUIIKNIIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c17-12-11-15-7-9-16(10-8-15)14(18)6-5-13-3-1-2-4-13/h13,17H,1-12H2.
What are the key properties of 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one?
3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one has a molecular weight of 254.37 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one is sourced from PubChem (CID 43390851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).