2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol

C13H18FNO2 — CID 10444260

IUPAC2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol
SMILESCCCN1CCO[C@@H](c2ccc(F)c(O)c2)C1
InChIInChI=1S/C13H18FNO2/c1-2-5-15-6-7-17-13(9-15)10-3-4-11(14)12(16)8-10/h3-4,8,13,16H,2,5-7,9H2,1H3/t13-/m1/s1
InChIKeyGGNXXNYKGWVORA-CYBMUJFWSA-N
MW239.29 g/mol
LogP2.31
Rot. Bonds3

About 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol

2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol (PubChem CID 10444260) has the molecular formula C13H18FNO2 and a molecular weight of 239.29 g/mol. Its IUPAC name is 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol.

Molecular Properties

Compound Name2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol
PubChem CID10444260
Molecular FormulaC13H18FNO2
Molecular Weight239.29 g/mol
Exact Mass239.13
IUPAC Name2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol
SMILESCCCN1CCO[C@@H](c2ccc(F)c(O)c2)C1
InChIInChI=1S/C13H18FNO2/c1-2-5-15-6-7-17-13(9-15)10-3-4-11(14)12(16)8-10/h3-4,8,13,16H,2,5-7,9H2,1H3/t13-/m1/s1
InChIKeyGGNXXNYKGWVORA-CYBMUJFWSA-N
XLogP2.31
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol 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-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol?
The IUPAC name of 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol (CID 10444260) is 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol.
What is the SMILES notation for 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol?
The canonical SMILES for 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol is CCCN1CCO[C@@H](c2ccc(F)c(O)c2)C1.
What is the InChIKey of 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol?
The InChIKey is GGNXXNYKGWVORA-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H18FNO2/c1-2-5-15-6-7-17-13(9-15)10-3-4-11(14)12(16)8-10/h3-4,8,13,16H,2,5-7,9H2,1H3/t13-/m1/s1.
What are the key properties of 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol?
2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol has a molecular weight of 239.29 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-[(2S)-4-propylmorpholin-2-yl]phenol is sourced from PubChem (CID 10444260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).