(1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol

C11H16FNO2 — CID 63371010

IUPAC(1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol
SMILESC[C@@H](O)c1c(F)cccc1N(C)CCO
InChIInChI=1S/C11H16FNO2/c1-8(15)11-9(12)4-3-5-10(11)13(2)6-7-14/h3-5,8,14-15H,6-7H2,1-2H3/t8-/m1/s1
InChIKeyMBJOUUKBSWLWIW-MRVPVSSYSA-N
MW213.25 g/mol
LogP1.31
Rot. Bonds4

About (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol

(1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol (PubChem CID 63371010) has the molecular formula C11H16FNO2 and a molecular weight of 213.25 g/mol. Its IUPAC name is (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol
PubChem CID63371010
Molecular FormulaC11H16FNO2
Molecular Weight213.25 g/mol
Exact Mass213.12
IUPAC Name(1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol
SMILESC[C@@H](O)c1c(F)cccc1N(C)CCO
InChIInChI=1S/C11H16FNO2/c1-8(15)11-9(12)4-3-5-10(11)13(2)6-7-14/h3-5,8,14-15H,6-7H2,1-2H3/t8-/m1/s1
InChIKeyMBJOUUKBSWLWIW-MRVPVSSYSA-N
XLogP1.31
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.25
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[3-(dimethylamino)propyl-methylamino]-6-fluorophenyl]ethanol
CID 55226767
(1R)-1-[2-[butyl(methyl)amino]-6-fluorophenyl]ethanol
CID 63371580
3-[3-fluoro-2-(1-hydroxyethyl)-N-methylanilino]propanenitrile
CID 43506029
(1R)-1-[2-[ethyl(2-hydroxyethyl)amino]-6-fluorophenyl]ethanol
CID 63371083
(1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol
CID 63371539
(1S)-1-[2-fluoro-6-[methyl(2-pyridin-4-ylethyl)amino]phenyl]ethanol
CID 78939866
(1R)-1-[2-fluoro-6-[methyl-[(2-methylphenyl)methyl]amino]phenyl]ethanol
CID 63371123
(1S)-1-[2-fluoro-6-(2-fluoro-N-methylanilino)phenyl]ethanol
CID 55184318
(1R)-1-[2-fluoro-6-(2-fluoro-N-methylanilino)phenyl]ethanol
CID 78940926
(1R)-1-[2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-6-fluorophenyl]ethanol
CID 105415634
1-[2-fluoro-6-[furan-2-ylmethyl(methyl)amino]phenyl]ethanol
CID 43527064
(1S)-1-[2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-6-fluorophenyl]ethanol
CID 105415669

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol?
The IUPAC name of (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol (CID 63371010) is (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol is C[C@@H](O)c1c(F)cccc1N(C)CCO.
What is the InChIKey of (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol?
The InChIKey is MBJOUUKBSWLWIW-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H16FNO2/c1-8(15)11-9(12)4-3-5-10(11)13(2)6-7-14/h3-5,8,14-15H,6-7H2,1-2H3/t8-/m1/s1.
What are the key properties of (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol?
(1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol has a molecular weight of 213.25 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol is sourced from PubChem (CID 63371010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).