3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol

C15H17FN2O — CID 107714620

IUPAC3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol
SMILESCC(NC(C)c1ccc(O)cc1F)c1ccccn1
InChIInChI=1S/C15H17FN2O/c1-10(13-7-6-12(19)9-14(13)16)18-11(2)15-5-3-4-8-17-15/h3-11,18-19H,1-2H3
InChIKeyJZJSMAAXJUBBOB-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.34
Rot. Bonds4

About 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol

3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol (PubChem CID 107714620) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol.

Molecular Properties

Compound Name3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol
PubChem CID107714620
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol
SMILESCC(NC(C)c1ccc(O)cc1F)c1ccccn1
InChIInChI=1S/C15H17FN2O/c1-10(13-7-6-12(19)9-14(13)16)18-11(2)15-5-3-4-8-17-15/h3-11,18-19H,1-2H3
InChIKeyJZJSMAAXJUBBOB-UHFFFAOYSA-N
XLogP3.34
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol 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-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine
CID 43202625
5-methoxy-2-[1-[[(1R)-1-pyridin-2-ylethyl]amino]ethyl]phenol
CID 81402064
4-[1-[[(1S)-1-(2-bromophenyl)ethyl]amino]ethyl]-3-fluorophenol
CID 107715306
1-(2-chloro-4-fluorophenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81401324
1-(2-bromo-4-fluorophenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 103931399
4-[1-[[(1R)-1-(2-fluorophenyl)ethyl]amino]ethyl]benzene-1,3-diol
CID 81379941
3-fluoro-4-[1-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]phenol
CID 107715315
1-(2-methylphenyl)-N-(1-pyridin-2-ylethyl)ethanamine
CID 43203224
4-[1-[[(1R)-1-(4-chlorophenyl)ethyl]amino]ethyl]-3-fluorophenol
CID 107715286
1-(3-fluoro-4-methylphenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81401331
(1R)-1-(3-fluorophenyl)-N-(1-pyridin-2-ylethyl)ethanamine
CID 81367216
1-(3-fluorophenyl)-N-[(1R)-1-pyridin-2-ylethyl]ethanamine
CID 81402285

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol?
The IUPAC name of 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol (CID 107714620) is 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol.
What is the SMILES notation for 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol?
The canonical SMILES for 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol is CC(NC(C)c1ccc(O)cc1F)c1ccccn1.
What is the InChIKey of 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol?
The InChIKey is JZJSMAAXJUBBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-10(13-7-6-12(19)9-14(13)16)18-11(2)15-5-3-4-8-17-15/h3-11,18-19H,1-2H3.
What are the key properties of 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol?
3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol has a molecular weight of 260.31 g/mol, XLogP of 3.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol is sourced from PubChem (CID 107714620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).