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

C6H14N2O — CID 175688387

IUPAC2-(4-deuteriopiperazin-1-yl)ethanol
SMILES[2H]N1CCN(CCO)CC1
InChIInChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2/i/hD
InChIKeyWFCSWCVEJLETKA-DYCDLGHISA-N
MW131.20 g/mol
LogP-1.12
Rot. Bonds2

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

2-(4-deuteriopiperazin-1-yl)ethanol (PubChem CID 175688387) has the molecular formula C6H14N2O and a molecular weight of 131.20 g/mol. Its IUPAC name is 2-(4-deuteriopiperazin-1-yl)ethanol.

Molecular Properties

Compound Name2-(4-deuteriopiperazin-1-yl)ethanol
PubChem CID175688387
Molecular FormulaC6H14N2O
Molecular Weight131.20 g/mol
Exact Mass131.12
IUPAC Name2-(4-deuteriopiperazin-1-yl)ethanol
SMILES[2H]N1CCN(CCO)CC1
InChIInChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2/i/hD
InChIKeyWFCSWCVEJLETKA-DYCDLGHISA-N
XLogP-1.12
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.20
LogP ≤ 5-1.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,4,7,10-tetrazacyclododec-1-yl)ethanol
CID 12963738
2-piperazin-1-ylethanol;dihydrochloride
CID 21254470
2-[4,7-bis(2-hydroxyethyl)-1,4,7,10-tetrazacyclododec-1-yl]ethanol
CID 70808226
azane;2-piperazin-1-ylethanol
CID 23318747
ethene;2-piperazin-1-ylethanol
CID 175244492
methanamine;2-piperazin-1-ylethanol
CID 142253011
2-[4-[2-[4,7-bis(2-hydroxyethyl)-1,4,7-triazonan-1-yl]ethyl]-7-(2-hydroxyethyl)-1,4,7-triazonan-1-yl]ethanol
CID 18512424
2-(1,4-diazepan-1-yl)ethanol
CID 2736550
2-(1,5,9-triazacyclododec-1-yl)ethanol
CID 11143375
2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol;[4-(hydroxymethyl)piperazin-1-yl]methanol
CID 69172076
2-[1,4-bis(2-hydroxyethyl)-1,4,8,12-tetrazacyclopentadec-8-yl]ethanol
CID 70808244
bis(2-piperidin-1-ylethanol);dihydroiodide
CID 175097300

Frequently Asked Questions

What is the IUPAC name of 2-(4-deuteriopiperazin-1-yl)ethanol?
The IUPAC name of 2-(4-deuteriopiperazin-1-yl)ethanol (CID 175688387) is 2-(4-deuteriopiperazin-1-yl)ethanol.
What is the SMILES notation for 2-(4-deuteriopiperazin-1-yl)ethanol?
The canonical SMILES for 2-(4-deuteriopiperazin-1-yl)ethanol is [2H]N1CCN(CCO)CC1.
What is the InChIKey of 2-(4-deuteriopiperazin-1-yl)ethanol?
The InChIKey is WFCSWCVEJLETKA-DYCDLGHISA-N. The full InChI is InChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2/i/hD.
What are the key properties of 2-(4-deuteriopiperazin-1-yl)ethanol?
2-(4-deuteriopiperazin-1-yl)ethanol has a molecular weight of 131.20 g/mol, XLogP of -1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-deuteriopiperazin-1-yl)ethanol is sourced from PubChem (CID 175688387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).