5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol

C9H12FNO — CID 67474806

IUPAC5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol
SMILESC[C@@H](N)Cc1ccc([18F])c(O)c1
InChIInChI=1S/C9H12FNO/c1-6(11)4-7-2-3-8(10)9(12)5-7/h2-3,5-6,12H,4,11H2,1H3/t6-/m1/s1/i10-1
InChIKeyOJIARUHSWZIZCJ-CDSXIGCZSA-N
MW168.20 g/mol
LogP1.42
Rot. Bonds2

About 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol

5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol (PubChem CID 67474806) has the molecular formula C9H12FNO and a molecular weight of 168.20 g/mol. Its IUPAC name is 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol.

Molecular Properties

Compound Name5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol
PubChem CID67474806
Molecular FormulaC9H12FNO
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol
SMILESC[C@@H](N)Cc1ccc([18F])c(O)c1
InChIInChI=1S/C9H12FNO/c1-6(11)4-7-2-3-8(10)9(12)5-7/h2-3,5-6,12H,4,11H2,1H3/t6-/m1/s1/i10-1
InChIKeyOJIARUHSWZIZCJ-CDSXIGCZSA-N
XLogP1.42
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)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

4-(2-aminopropyl)benzene-1,2-diol;ethane
CID 169229376
1-(3-ethyl-4-fluorophenyl)propan-2-amine
CID 117278913
1-(3-chloro-4-fluorophenyl)propan-2-amine
CID 55254568
methyl 2-amino-3-(4-fluoro-3-hydroxyphenyl)propanoate
CID 77391788
5-(2-aminopropyl)-2-fluoro-3-methylphenol
CID 117279526
5-(aminomethyl)-2-fluorophenol;hydrobromide
CID 68744209
5-[(2R)-2-aminopropyl]-3-methylbenzene-1,2-diol
CID 89349116
1-[4-fluoro-3-(trifluoromethoxy)phenyl]propan-2-amine
CID 170891288
1-(4-chlorophenyl)propan-2-amine
CID 3127
2-(2-aminopropyl)-5-chlorophenol
CID 83697150
4-[(2S)-2-aminopropyl]phenol;methanol
CID 142971966
4-(2-aminopropyl)phenol;dihydrobromide
CID 23615767

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol?
The IUPAC name of 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol (CID 67474806) is 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol.
What is the SMILES notation for 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol?
The canonical SMILES for 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol is C[C@@H](N)Cc1ccc([18F])c(O)c1.
What is the InChIKey of 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol?
The InChIKey is OJIARUHSWZIZCJ-CDSXIGCZSA-N. The full InChI is InChI=1S/C9H12FNO/c1-6(11)4-7-2-3-8(10)9(12)5-7/h2-3,5-6,12H,4,11H2,1H3/t6-/m1/s1/i10-1.
What are the key properties of 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol?
5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol has a molecular weight of 168.20 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol is sourced from PubChem (CID 67474806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).