2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol

C17H34N2O — CID 45179793

IUPAC2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol
SMILESCCC(CC)CN1CCN(C2CCCC2)C(CCO)C1
InChIInChI=1S/C17H34N2O/c1-3-15(4-2)13-18-10-11-19(16-7-5-6-8-16)17(14-18)9-12-20/h15-17,20H,3-14H2,1-2H3
InChIKeyKIGMJIYOBWCDRE-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.73
Rot. Bonds7

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

2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol (PubChem CID 45179793) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol
PubChem CID45179793
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol
SMILESCCC(CC)CN1CCN(C2CCCC2)C(CCO)C1
InChIInChI=1S/C17H34N2O/c1-3-15(4-2)13-18-10-11-19(16-7-5-6-8-16)17(14-18)9-12-20/h15-17,20H,3-14H2,1-2H3
InChIKeyKIGMJIYOBWCDRE-UHFFFAOYSA-N
XLogP2.73
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(Cyclohexylmethyl)-1-cyclopentylpiperazin-2-yl]ethanol
CID 23723609
2-[4-Cyclopentyl-1-(1-isopropylpiperidin-4-yl)piperazin-2-yl]ethanol
CID 16187348
2-[4-(2-Ethylbutyl)-1-(3-methylbutyl)piperazin-2-yl]ethanol
CID 16192313
2-(1-Cyclopentyl-4-methyl-2-piperazinyl)ethanol
CID 45199748
2-[4-Isobutyl-1-(1-isopropylpiperidin-4-yl)piperazin-2-yl]ethanol
CID 16188196
[(3S,4S)-3-(dimethylamino)-1-(1-methylpiperidin-4-yl)piperidin-4-yl]methanol
CID 110197508
[1-Cycloheptyl-3-(dimethylamino)piperidin-4-YL]methanol
CID 110197510
[1-Cyclohexyl-3-(dimethylamino)piperidin-4-YL]methanol
CID 110197513
[1-Cyclopentyl-3-(dimethylamino)piperidin-4-YL]methanol
CID 110197514
[3-(Dimethylamino)-1'-ethyl-[1,4'-bipiperidin]-4-YL]methanol
CID 124074263
2-[(2S)-4-(3-cyclopentylpropyl)-1-(1-propan-2-ylpiperidin-4-yl)piperazin-2-yl]ethanol
CID 28957521
2-[(2S)-4-(3-cyclopentylpropyl)-1-methylpiperazin-2-yl]ethanol
CID 29153175

Frequently Asked Questions

What is the IUPAC name of 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol?
The IUPAC name of 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol (CID 45179793) is 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol.
What is the SMILES notation for 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol?
The canonical SMILES for 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol is CCC(CC)CN1CCN(C2CCCC2)C(CCO)C1.
What is the InChIKey of 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol?
The InChIKey is KIGMJIYOBWCDRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-3-15(4-2)13-18-10-11-19(16-7-5-6-8-16)17(14-18)9-12-20/h15-17,20H,3-14H2,1-2H3.
What are the key properties of 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol?
2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol has a molecular weight of 282.47 g/mol, XLogP of 2.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-cyclopentyl-4-(2-ethylbutyl)piperazin-2-yl]ethanol is sourced from PubChem (CID 45179793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).