2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol

C7H14FNO — CID 105429072

IUPAC2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol
SMILESCN1CCCC1C(F)CO
InChIInChI=1S/C7H14FNO/c1-9-4-2-3-7(9)6(8)5-10/h6-7,10H,2-5H2,1H3
InChIKeyNMMVURSXTSTJBQ-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.41
Rot. Bonds2

About 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol

2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol (PubChem CID 105429072) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol.

Molecular Properties

Compound Name2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol
PubChem CID105429072
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol
SMILESCN1CCCC1C(F)CO
InChIInChI=1S/C7H14FNO/c1-9-4-2-3-7(9)6(8)5-10/h6-7,10H,2-5H2,1H3
InChIKeyNMMVURSXTSTJBQ-UHFFFAOYSA-N
XLogP0.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-[(2R)-1-methylpyrrolidin-2-yl]ethanol
CID 155904197
(1S)-1-[(2R)-1-methylpyrrolidin-2-yl]propan-1-ol;(1R)-1-[(2S)-1-methylpyrrolidin-2-yl]propan-1-ol
CID 165045426
ethane;methane;tetrakis([(2S)-1-methylpyrrolidin-2-yl]methanediol);tetrakis([(2R)-1-methylpyrrolidin-2-yl]methanediol)
CID 159344358
2-(difluoromethyl)-1-methylazepane
CID 123397217
(1S)-1-(1-methylpyrrolidin-2-yl)ethanamine
CID 59120846
ethane;(2S)-2-(2-fluoro-1-methoxyethyl)-1-methylpyrrolidine
CID 168995701
1-methyl-2-octan-4-ylpyrrolidine
CID 167172274
(2S)-2-dodecan-6-yl-1-methylpyrrolidine
CID 130410209
(2R)-3-(1-methylpyrrolidin-2-yl)propane-1,2-diol
CID 142317689
hydroxy-[(2S)-1-methylpyrrolidin-2-yl]methanesulfonic acid;tungsten
CID 59075961
ethane;2-(1-ethoxyethyl)-1-methylpyrrolidine
CID 176920826
(2R)-2-cyclobutyl-2-fluoroethanol
CID 129462304

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol?
The IUPAC name of 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol (CID 105429072) is 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol.
What is the SMILES notation for 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol?
The canonical SMILES for 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol is CN1CCCC1C(F)CO.
What is the InChIKey of 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol?
The InChIKey is NMMVURSXTSTJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-9-4-2-3-7(9)6(8)5-10/h6-7,10H,2-5H2,1H3.
What are the key properties of 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol?
2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol has a molecular weight of 147.19 g/mol, XLogP of 0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(1-methylpyrrolidin-2-yl)ethanol is sourced from PubChem (CID 105429072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).