2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol

C9H19FN2O — CID 106618061

IUPAC2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESOCCN(CCF)CC1CCCN1
InChIInChI=1S/C9H19FN2O/c10-3-5-12(6-7-13)8-9-2-1-4-11-9/h9,11,13H,1-8H2
InChIKeyKCOGNEKNRMLZQD-UHFFFAOYSA-N
MW190.26 g/mol
LogP0.00
Rot. Bonds6

About 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol

2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol (PubChem CID 106618061) has the molecular formula C9H19FN2O and a molecular weight of 190.26 g/mol. Its IUPAC name is 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol
PubChem CID106618061
Molecular FormulaC9H19FN2O
Molecular Weight190.26 g/mol
Exact Mass190.15
IUPAC Name2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESOCCN(CCF)CC1CCCN1
InChIInChI=1S/C9H19FN2O/c10-3-5-12(6-7-13)8-9-2-1-4-11-9/h9,11,13H,1-8H2
InChIKeyKCOGNEKNRMLZQD-UHFFFAOYSA-N
XLogP0.00
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.26
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol?
The IUPAC name of 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol (CID 106618061) is 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol is OCCN(CCF)CC1CCCN1.
What is the InChIKey of 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol?
The InChIKey is KCOGNEKNRMLZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FN2O/c10-3-5-12(6-7-13)8-9-2-1-4-11-9/h9,11,13H,1-8H2.
What are the key properties of 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol?
2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol has a molecular weight of 190.26 g/mol, XLogP of 0.00, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-fluoroethyl(pyrrolidin-2-ylmethyl)amino]ethanol is sourced from PubChem (CID 106618061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).