2-[2-fluoroethyl(prop-2-enyl)amino]ethanol

C7H14FNO — CID 115694995

IUPAC2-[2-fluoroethyl(prop-2-enyl)amino]ethanol
SMILESC=CCN(CCO)CCF
InChIInChI=1S/C7H14FNO/c1-2-4-9(5-3-8)6-7-10/h2,10H,1,3-7H2
InChIKeyJQKRLRYKPQFZFZ-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.44
Rot. Bonds6

About 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol

2-[2-fluoroethyl(prop-2-enyl)amino]ethanol (PubChem CID 115694995) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-fluoroethyl(prop-2-enyl)amino]ethanol
PubChem CID115694995
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name2-[2-fluoroethyl(prop-2-enyl)amino]ethanol
SMILESC=CCN(CCO)CCF
InChIInChI=1S/C7H14FNO/c1-2-4-9(5-3-8)6-7-10/h2,10H,1,3-7H2
InChIKeyJQKRLRYKPQFZFZ-UHFFFAOYSA-N
XLogP0.44
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-[2-fluoroethyl(prop-2-enyl)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

Related Compounds

N-Allyl-2,2'-iminodiethanol
CID 41439
2-(Diallylamino)ethanol
CID 253018
Allyl dimethyl hydroxyethylammonium chloride
CID 14327232
2-[Methyl(prop-2-enyl)amino]ethanol
CID 3780678
Allyl tris-(2-hydroxyethyl)ammonium chloride
CID 87969591
2-[1-Fluoroprop-2-enyl(2-hydroxyethyl)amino]ethanol
CID 88499328
2-[3-Fluoroprop-2-enyl(2-hydroxyethyl)amino]ethanol
CID 173368370
2-[[(E)-but-2-enyl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 103864854
2-[[(E)-but-2-enyl]-(2,2-difluoroethyl)amino]ethanol
CID 107485340
2-[Prop-2-enyl(2,2,2-trifluoroethyl)amino]ethanol
CID 115631860
2-[2,2-Difluoroethyl(prop-2-enyl)amino]ethanol
CID 115631933
2-[Prop-2-enyl(3,3,3-trifluoropropyl)amino]ethanol
CID 115644305

Frequently Asked Questions

What is the IUPAC name of 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol?
The IUPAC name of 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol (CID 115694995) is 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol.
What is the SMILES notation for 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol?
The canonical SMILES for 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol is C=CCN(CCO)CCF.
What is the InChIKey of 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol?
The InChIKey is JQKRLRYKPQFZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-2-4-9(5-3-8)6-7-10/h2,10H,1,3-7H2.
What are the key properties of 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol?
2-[2-fluoroethyl(prop-2-enyl)amino]ethanol has a molecular weight of 147.19 g/mol, XLogP of 0.44, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-fluoroethyl(prop-2-enyl)amino]ethanol is sourced from PubChem (CID 115694995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).