2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride

C11H21ClN2O2 — CID 119402733

IUPAC2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride
SMILESCl.O=C(COC1CCCC1)N1CCNCC1
InChIInChI=1S/C11H20N2O2.ClH/c14-11(13-7-5-12-6-8-13)9-15-10-3-1-2-4-10;/h10,12H,1-9H2;1H
InChIKeyRMYGBMMANOJZEU-UHFFFAOYSA-N
MW248.75 g/mol
LogP0.80
Rot. Bonds3

About 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride

2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride (PubChem CID 119402733) has the molecular formula C11H21ClN2O2 and a molecular weight of 248.75 g/mol. Its IUPAC name is 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride.

Molecular Properties

Compound Name2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride
PubChem CID119402733
Molecular FormulaC11H21ClN2O2
Molecular Weight248.75 g/mol
Exact Mass248.13
IUPAC Name2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride
SMILESCl.O=C(COC1CCCC1)N1CCNCC1
InChIInChI=1S/C11H20N2O2.ClH/c14-11(13-7-5-12-6-8-13)9-15-10-3-1-2-4-10;/h10,12H,1-9H2;1H
InChIKeyRMYGBMMANOJZEU-UHFFFAOYSA-N
XLogP0.80
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.75
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride?
The IUPAC name of 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride (CID 119402733) is 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride.
What is the SMILES notation for 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride?
The canonical SMILES for 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride is Cl.O=C(COC1CCCC1)N1CCNCC1.
What is the InChIKey of 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride?
The InChIKey is RMYGBMMANOJZEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2.ClH/c14-11(13-7-5-12-6-8-13)9-15-10-3-1-2-4-10;/h10,12H,1-9H2;1H.
What are the key properties of 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride?
2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride has a molecular weight of 248.75 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-1-piperazin-1-ylethanone;hydrochloride is sourced from PubChem (CID 119402733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).