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

C12H18FNO — CID 63371539

IUPAC(1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol
SMILESCC(C)N(C)c1cccc(F)c1[C@@H](C)O
InChIInChI=1S/C12H18FNO/c1-8(2)14(4)11-7-5-6-10(13)12(11)9(3)15/h5-9,15H,1-4H3/t9-/m1/s1
InChIKeyRMWKRBMUGMAQIB-SECBINFHSA-N
MW211.28 g/mol
LogP2.72
Rot. Bonds3

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

(1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol (PubChem CID 63371539) has the molecular formula C12H18FNO and a molecular weight of 211.28 g/mol. Its IUPAC name is (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol
PubChem CID63371539
Molecular FormulaC12H18FNO
Molecular Weight211.28 g/mol
Exact Mass211.14
IUPAC Name(1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol
SMILESCC(C)N(C)c1cccc(F)c1[C@@H](C)O
InChIInChI=1S/C12H18FNO/c1-8(2)14(4)11-7-5-6-10(13)12(11)9(3)15/h5-9,15H,1-4H3/t9-/m1/s1
InChIKeyRMWKRBMUGMAQIB-SECBINFHSA-N
XLogP2.72
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.28
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-fluoro-6-[methyl(3-methylbutan-2-yl)amino]phenyl]ethanol
CID 43570328
(1R)-1-[2-fluoro-6-(2-fluoro-N-methylanilino)phenyl]ethanol
CID 78940926
(1S)-1-[2-fluoro-6-(2-fluoro-N-methylanilino)phenyl]ethanol
CID 55184318
(1R)-1-[2-fluoro-6-[2-hydroxyethyl(methyl)amino]phenyl]ethanol
CID 63371010
1-[2-[3-(dimethylamino)propyl-methylamino]-6-fluorophenyl]ethanol
CID 55226767
(1S)-1-[2-fluoro-6-[methyl(1-thiophen-2-ylethyl)amino]phenyl]ethanol
CID 78940338
(1S)-1-[2-[ethyl(propan-2-yl)amino]-6-fluorophenyl]ethanol
CID 78939528
(1R)-1-[2-[ethyl(propan-2-yl)amino]-6-fluorophenyl]ethanol
CID 63370786
1-(2,6-difluorophenyl)ethanol
CID 5012075
(1R)-1-[2-[butyl(methyl)amino]-6-fluorophenyl]ethanol
CID 63371580
(1S)-1-[2-fluoro-6-[2-methylpropyl(propan-2-yl)amino]phenyl]ethanol
CID 55183938
1-[2-fluoro-6-[methyl(2-methylbutan-2-yl)amino]phenyl]ethanol
CID 63965516

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol?
The IUPAC name of (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol (CID 63371539) is (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol is CC(C)N(C)c1cccc(F)c1[C@@H](C)O.
What is the InChIKey of (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol?
The InChIKey is RMWKRBMUGMAQIB-SECBINFHSA-N. The full InChI is InChI=1S/C12H18FNO/c1-8(2)14(4)11-7-5-6-10(13)12(11)9(3)15/h5-9,15H,1-4H3/t9-/m1/s1.
What are the key properties of (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol?
(1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol has a molecular weight of 211.28 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-fluoro-6-[methyl(propan-2-yl)amino]phenyl]ethanol is sourced from PubChem (CID 63371539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).