[2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol

C8H16FNO — CID 170357246

IUPAC[2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol
SMILESCN1CCCC1(CO)CCF
InChIInChI=1S/C8H16FNO/c1-10-6-2-3-8(10,7-11)4-5-9/h11H,2-7H2,1H3
InChIKeyILXPLINSBXFXFX-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.80
Rot. Bonds3

About [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol

[2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol (PubChem CID 170357246) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol
PubChem CID170357246
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name[2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol
SMILESCN1CCCC1(CO)CCF
InChIInChI=1S/C8H16FNO/c1-10-6-2-3-8(10,7-11)4-5-9/h11H,2-7H2,1H3
InChIKeyILXPLINSBXFXFX-UHFFFAOYSA-N
XLogP0.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol?
The IUPAC name of [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol (CID 170357246) is [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol?
The canonical SMILES for [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol is CN1CCCC1(CO)CCF.
What is the InChIKey of [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol?
The InChIKey is ILXPLINSBXFXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-10-6-2-3-8(10,7-11)4-5-9/h11H,2-7H2,1H3.
What are the key properties of [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol?
[2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol has a molecular weight of 161.22 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoroethyl)-1-methylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 170357246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).