2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol

C10H21FN2O — CID 106618323

IUPAC2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESOCCN(CCCF)CC1CCCN1
InChIInChI=1S/C10H21FN2O/c11-4-2-6-13(7-8-14)9-10-3-1-5-12-10/h10,12,14H,1-9H2
InChIKeyIIAQESHKFJLQAO-UHFFFAOYSA-N
MW204.29 g/mol
LogP0.39
Rot. Bonds7

About 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol

2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol (PubChem CID 106618323) has the molecular formula C10H21FN2O and a molecular weight of 204.29 g/mol. Its IUPAC name is 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol
PubChem CID106618323
Molecular FormulaC10H21FN2O
Molecular Weight204.29 g/mol
Exact Mass204.16
IUPAC Name2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESOCCN(CCCF)CC1CCCN1
InChIInChI=1S/C10H21FN2O/c11-4-2-6-13(7-8-14)9-10-3-1-5-12-10/h10,12,14H,1-9H2
InChIKeyIIAQESHKFJLQAO-UHFFFAOYSA-N
XLogP0.39
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol 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-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol?
The IUPAC name of 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol (CID 106618323) is 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol is OCCN(CCCF)CC1CCCN1.
What is the InChIKey of 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol?
The InChIKey is IIAQESHKFJLQAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FN2O/c11-4-2-6-13(7-8-14)9-10-3-1-5-12-10/h10,12,14H,1-9H2.
What are the key properties of 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol?
2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol has a molecular weight of 204.29 g/mol, XLogP of 0.39, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-fluoropropyl(pyrrolidin-2-ylmethyl)amino]ethanol is sourced from PubChem (CID 106618323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).