1-fluoro-2-(4-methylpiperazin-1-yl)ethanol

C7H15FN2O — CID 167149180

IUPAC1-fluoro-2-(4-methylpiperazin-1-yl)ethanol
SMILESCN1CCN(CC(O)F)CC1
InChIInChI=1S/C7H15FN2O/c1-9-2-4-10(5-3-9)6-7(8)11/h7,11H,2-6H2,1H3
InChIKeyWEYDHIBBVQUPGJ-UHFFFAOYSA-N
MW162.21 g/mol
LogP-0.48
Rot. Bonds2

About 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol

1-fluoro-2-(4-methylpiperazin-1-yl)ethanol (PubChem CID 167149180) has the molecular formula C7H15FN2O and a molecular weight of 162.21 g/mol. Its IUPAC name is 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name1-fluoro-2-(4-methylpiperazin-1-yl)ethanol
PubChem CID167149180
Molecular FormulaC7H15FN2O
Molecular Weight162.21 g/mol
Exact Mass162.12
IUPAC Name1-fluoro-2-(4-methylpiperazin-1-yl)ethanol
SMILESCN1CCN(CC(O)F)CC1
InChIInChI=1S/C7H15FN2O/c1-9-2-4-10(5-3-9)6-7(8)11/h7,11H,2-6H2,1H3
InChIKeyWEYDHIBBVQUPGJ-UHFFFAOYSA-N
XLogP-0.48
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.21
LogP ≤ 5-0.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-Hydroxyethyl)-4-methylpiperazine
CID 231184
2-(4-Ethylpiperazin-1-yl)ethan-1-ol
CID 18985154
2-[4-(2-Fluoroethyl)piperazin-1-YL]ethanol
CID 45099649
2-(4-(2,2,2-Trifluoroethyl)piperazin-1-yl)ethan-1-ol
CID 60744112
2-[4-(2,2-Difluoroethyl)piperazin-1-yl]ethanol
CID 62022864
2-[4-(1-Fluoroethyl)piperazin-1-yl]ethanol
CID 69131590
2-[4-(4-Fluorobutyl)piperazin-1-yl]ethanol
CID 70970390
1-Fluoro-3-(4-methylpiperazin-1-yl)propan-2-ol
CID 117744737
2-[4-(Trifluoromethyl)piperazin-1-yl]ethanol
CID 134820986
1-(2-Fluoroethyl)piperazin-2-ol
CID 141013840
2-(4-Fluoropiperazin-1-yl)ethanol
CID 145343637
1-Fluoro-2-(4-propan-2-ylpiperazin-1-yl)ethanol
CID 165160446

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol?
The IUPAC name of 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol (CID 167149180) is 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol.
What is the SMILES notation for 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol?
The canonical SMILES for 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol is CN1CCN(CC(O)F)CC1.
What is the InChIKey of 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol?
The InChIKey is WEYDHIBBVQUPGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2O/c1-9-2-4-10(5-3-9)6-7(8)11/h7,11H,2-6H2,1H3.
What are the key properties of 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol?
1-fluoro-2-(4-methylpiperazin-1-yl)ethanol has a molecular weight of 162.21 g/mol, XLogP of -0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-(4-methylpiperazin-1-yl)ethanol is sourced from PubChem (CID 167149180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).