2-[2-fluoroethyl(methyl)amino]ethanol

C5H12FNO — CID 46209411

IUPAC2-[2-fluoroethyl(methyl)amino]ethanol
SMILESCN(CCO)CCF
InChIInChI=1S/C5H12FNO/c1-7(3-2-6)4-5-8/h8H,2-5H2,1H3
InChIKeyNQICUMFZYPGYSW-UHFFFAOYSA-N
MW121.16 g/mol
LogP-0.12
Rot. Bonds4

About 2-[2-fluoroethyl(methyl)amino]ethanol

2-[2-fluoroethyl(methyl)amino]ethanol (PubChem CID 46209411) has the molecular formula C5H12FNO and a molecular weight of 121.16 g/mol. Its IUPAC name is 2-[2-fluoroethyl(methyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-fluoroethyl(methyl)amino]ethanol
PubChem CID46209411
Molecular FormulaC5H12FNO
Molecular Weight121.16 g/mol
Exact Mass121.09
IUPAC Name2-[2-fluoroethyl(methyl)amino]ethanol
SMILESCN(CCO)CCF
InChIInChI=1S/C5H12FNO/c1-7(3-2-6)4-5-8/h8H,2-5H2,1H3
InChIKeyNQICUMFZYPGYSW-UHFFFAOYSA-N
XLogP-0.12
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.16
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Triethanolamine
CID 7618
Choline
CID 305
2-(Dimethylamino)ethanol
CID 7902
Choline Chloride
CID 6209
Diethylethanolamine
CID 7497
N-Methyldiethanolamine
CID 7767
Choline, hydroxide
CID 31255
Ethyldiethanolamine
CID 8769
Choline C-11
CID 449688
Choline Bromide
CID 74724
Choline iodide
CID 87300
2-Diethylaminoethanol hydrochloride
CID 84429

Frequently Asked Questions

What is the IUPAC name of 2-[2-fluoroethyl(methyl)amino]ethanol?
The IUPAC name of 2-[2-fluoroethyl(methyl)amino]ethanol (CID 46209411) is 2-[2-fluoroethyl(methyl)amino]ethanol.
What is the SMILES notation for 2-[2-fluoroethyl(methyl)amino]ethanol?
The canonical SMILES for 2-[2-fluoroethyl(methyl)amino]ethanol is CN(CCO)CCF.
What is the InChIKey of 2-[2-fluoroethyl(methyl)amino]ethanol?
The InChIKey is NQICUMFZYPGYSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12FNO/c1-7(3-2-6)4-5-8/h8H,2-5H2,1H3.
What are the key properties of 2-[2-fluoroethyl(methyl)amino]ethanol?
2-[2-fluoroethyl(methyl)amino]ethanol has a molecular weight of 121.16 g/mol, XLogP of -0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-fluoroethyl(methyl)amino]ethanol is sourced from PubChem (CID 46209411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).