2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol

C12H26N2O2 — CID 19890001

IUPAC2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol
SMILESCCC1CN(CCO)CC(CC)N1CCO
InChIInChI=1S/C12H26N2O2/c1-3-11-9-13(5-7-15)10-12(4-2)14(11)6-8-16/h11-12,15-16H,3-10H2,1-2H3
InChIKeyPDQNIIXAMZFPAH-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.15
Rot. Bonds6

About 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol

2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol (PubChem CID 19890001) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol
PubChem CID19890001
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol
SMILESCCC1CN(CCO)CC(CC)N1CCO
InChIInChI=1S/C12H26N2O2/c1-3-11-9-13(5-7-15)10-12(4-2)14(11)6-8-16/h11-12,15-16H,3-10H2,1-2H3
InChIKeyPDQNIIXAMZFPAH-UHFFFAOYSA-N
XLogP0.15
TPSA46.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,4-Piperazinediethanol
CID 67151
1-(2-(N,N-Bis-(2-hydroxypropyl)-amino)-ethyl)-4-(2-hydroxypropyl)-piperazine
CID 98117
2,5-Dimethylpiperazine-1,4-diethanol
CID 73433
3,3'-(2-Methylpiperazine-1,4-diyl)dipropan-2-ol
CID 97925
alpha,alpha'-Dimethylpiperazine-1,4-diethanol
CID 96698
2-(4-Ethylpiperazin-1-yl)ethan-1-ol
CID 18985154
alpha,alpha',2,5-Tetramethylpiperazine-1,4-diethanol
CID 103795
1-(4-Methylpiperazin-1-yl)propan-2-ol
CID 12654592
3-[4-(2-Hydroxyethyl)piperazin-1-yl]propan-1-ol
CID 342524
(alphaS)-alpha,4-Dimethyl-1-piperazineethanol
CID 39235510
2-[2-[1-(Hydroxymethyl)propyl-methyl-amino]ethyl-methyl-amino]butan-1-ol
CID 469922
2-(4-Isopropylpiperazin-1-yl)ethanol
CID 4739630

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol (CID 19890001) is 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol is CCC1CN(CCO)CC(CC)N1CCO.
What is the InChIKey of 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol?
The InChIKey is PDQNIIXAMZFPAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-3-11-9-13(5-7-15)10-12(4-2)14(11)6-8-16/h11-12,15-16H,3-10H2,1-2H3.
What are the key properties of 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol?
2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol has a molecular weight of 230.35 g/mol, XLogP of 0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-diethyl-4-(2-hydroxyethyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 19890001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).