potassium 2-(4-cyclohexylpiperazin-1-yl)acetate

C12H21KN2O2 — CID 23674348

IUPACpotassium 2-(4-cyclohexylpiperazin-1-yl)acetate
SMILESO=C([O-])CN1CCN(C2CCCCC2)CC1.[K+]
InChIInChI=1S/C12H22N2O2.K/c15-12(16)10-13-6-8-14(9-7-13)11-4-2-1-3-5-11;/h11H,1-10H2,(H,15,16);/q;+1/p-1
InChIKeyLOWJRMDNFJLLNN-UHFFFAOYSA-M
MW264.41 g/mol
LogP-3.31
Rot. Bonds3

About potassium 2-(4-cyclohexylpiperazin-1-yl)acetate

potassium 2-(4-cyclohexylpiperazin-1-yl)acetate (PubChem CID 23674348) has the molecular formula C12H21KN2O2 and a molecular weight of 264.41 g/mol. Its IUPAC name is potassium 2-(4-cyclohexylpiperazin-1-yl)acetate.

Molecular Properties

Compound Namepotassium 2-(4-cyclohexylpiperazin-1-yl)acetate
PubChem CID23674348
Molecular FormulaC12H21KN2O2
Molecular Weight264.41 g/mol
Exact Mass264.12
IUPAC Namepotassium 2-(4-cyclohexylpiperazin-1-yl)acetate
SMILESO=C([O-])CN1CCN(C2CCCCC2)CC1.[K+]
InChIInChI=1S/C12H22N2O2.K/c15-12(16)10-13-6-8-14(9-7-13)11-4-2-1-3-5-11;/h11H,1-10H2,(H,15,16);/q;+1/p-1
InChIKeyLOWJRMDNFJLLNN-UHFFFAOYSA-M
XLogP-3.31
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 5-3.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze potassium 2-(4-cyclohexylpiperazin-1-yl)acetate with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-cyclopentylpiperazin-1-yl)-1-cyclopropylethanone
CID 63914774
2-(4-cyclobutylpiperazin-1-yl)acetamide;hydrochloride
CID 121020770
sodium;lutetium-177(3+);2-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetate
CID 169490819
N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide
CID 121184695
2-(4-cyclopentylpiperazin-1-yl)-N-(2-hydroxyethyl)acetamide
CID 62369296
1,4-dicyclopentylpiperazine;oxalic acid
CID 17369822
(4-cyclohexylpiperazin-1-yl)methanesulfinic acid
CID 174799485
N-(2-acetamidoethyl)-2-(4-cyclopentylpiperazin-1-yl)acetamide
CID 34423586
2-(4-cyclopentylpiperazin-1-yl)-1-(1,4-diazepan-1-yl)ethanone
CID 62370097
butyl 2-(4-cyclopentylpiperazin-1-yl)acetate
CID 55024857
1-cyclohexyl-4-ethylpiperazine;hydrochloride
CID 44598236
N-[(1R,2S)-2-tert-butylcyclohexyl]-2-(4-cyclohexylpiperazin-1-yl)acetamide
CID 51624821

Frequently Asked Questions

What is the IUPAC name of potassium 2-(4-cyclohexylpiperazin-1-yl)acetate?
The IUPAC name of potassium 2-(4-cyclohexylpiperazin-1-yl)acetate (CID 23674348) is potassium 2-(4-cyclohexylpiperazin-1-yl)acetate.
What is the SMILES notation for potassium 2-(4-cyclohexylpiperazin-1-yl)acetate?
The canonical SMILES for potassium 2-(4-cyclohexylpiperazin-1-yl)acetate is O=C([O-])CN1CCN(C2CCCCC2)CC1.[K+].
What is the InChIKey of potassium 2-(4-cyclohexylpiperazin-1-yl)acetate?
The InChIKey is LOWJRMDNFJLLNN-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H22N2O2.K/c15-12(16)10-13-6-8-14(9-7-13)11-4-2-1-3-5-11;/h11H,1-10H2,(H,15,16);/q;+1/p-1.
What are the key properties of potassium 2-(4-cyclohexylpiperazin-1-yl)acetate?
potassium 2-(4-cyclohexylpiperazin-1-yl)acetate has a molecular weight of 264.41 g/mol, XLogP of -3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-(4-cyclohexylpiperazin-1-yl)acetate is sourced from PubChem (CID 23674348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).