2-(4-butylpiperazin-1-yl)ethanol

C10H22N2O — CID 18695485

IUPAC2-(4-butylpiperazin-1-yl)ethanol
SMILESCCCCN1CCN(CCO)CC1
InChIInChI=1S/C10H22N2O/c1-2-3-4-11-5-7-12(8-6-11)9-10-13/h13H,2-10H2,1H3
InChIKeyONECAFFBSCAQDA-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.40
Rot. Bonds5

About 2-(4-butylpiperazin-1-yl)ethanol

2-(4-butylpiperazin-1-yl)ethanol (PubChem CID 18695485) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-(4-butylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name2-(4-butylpiperazin-1-yl)ethanol
PubChem CID18695485
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-(4-butylpiperazin-1-yl)ethanol
SMILESCCCCN1CCN(CCO)CC1
InChIInChI=1S/C10H22N2O/c1-2-3-4-11-5-7-12(8-6-11)9-10-13/h13H,2-10H2,1H3
InChIKeyONECAFFBSCAQDA-UHFFFAOYSA-N
XLogP0.40
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 67151
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CID 98117
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CID 73433
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CID 79208
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CID 97925
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CID 96698
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CID 7138432
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CID 18985154
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CID 103795
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CID 12654592
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CID 342524
CID 342524

Frequently Asked Questions

What is the IUPAC name of 2-(4-butylpiperazin-1-yl)ethanol?
The IUPAC name of 2-(4-butylpiperazin-1-yl)ethanol (CID 18695485) is 2-(4-butylpiperazin-1-yl)ethanol.
What is the SMILES notation for 2-(4-butylpiperazin-1-yl)ethanol?
The canonical SMILES for 2-(4-butylpiperazin-1-yl)ethanol is CCCCN1CCN(CCO)CC1.
What is the InChIKey of 2-(4-butylpiperazin-1-yl)ethanol?
The InChIKey is ONECAFFBSCAQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-2-3-4-11-5-7-12(8-6-11)9-10-13/h13H,2-10H2,1H3.
What are the key properties of 2-(4-butylpiperazin-1-yl)ethanol?
2-(4-butylpiperazin-1-yl)ethanol has a molecular weight of 186.30 g/mol, XLogP of 0.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-butylpiperazin-1-yl)ethanol is sourced from PubChem (CID 18695485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).