(1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol

C15H16FNO2 — CID 107720712

IUPAC(1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
SMILESCc1cccc(COc2ccc([C@H](C)O)c(F)c2)n1
InChIInChI=1S/C15H16FNO2/c1-10-4-3-5-12(17-10)9-19-13-6-7-14(11(2)18)15(16)8-13/h3-8,11,18H,9H2,1-2H3/t11-/m0/s1
InChIKeyFRBIOPZFYOSELO-NSHDSACASA-N
MW261.30 g/mol
LogP3.16
Rot. Bonds4

About (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol

(1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol (PubChem CID 107720712) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
PubChem CID107720712
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name(1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
SMILESCc1cccc(COc2ccc([C@H](C)O)c(F)c2)n1
InChIInChI=1S/C15H16FNO2/c1-10-4-3-5-12(17-10)9-19-13-6-7-14(11(2)18)15(16)8-13/h3-8,11,18H,9H2,1-2H3/t11-/m0/s1
InChIKeyFRBIOPZFYOSELO-NSHDSACASA-N
XLogP3.16
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-methoxy-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 82001009
(1R)-1-[2-fluoro-4-(pyrimidin-2-ylmethoxy)phenyl]ethanol
CID 107720035
(1R)-1-[2-fluoro-4-[(1-propan-2-ylpyrazol-3-yl)methoxy]phenyl]ethanol
CID 107720241
(1R)-1-[2-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol
CID 107720145
(1S)-1-[5-methyl-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 79267455
(1R)-1-[4-[(4,5-dimethyl-1,3-thiazol-2-yl)methoxy]-2-fluorophenyl]ethanol
CID 107719981
(1R)-1-[2-fluoro-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanol
CID 107719931
[4-[(6-methyl-2-pyridinyl)methoxy]phenyl]methanol
CID 79267363
(1S)-1-[2-fluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanol
CID 107720562
(1R)-1-[2-fluoro-4-(2-pyridin-2-ylethoxy)phenyl]ethanol
CID 107720301
(1S)-1-[2-fluoro-4-(pyridin-3-ylmethoxy)phenyl]ethanol
CID 107720608
(1R)-1-[4-[(3,4-difluorophenyl)methoxy]-2-fluorophenyl]ethanol
CID 107719922

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
The IUPAC name of (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol (CID 107720712) is (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
The canonical SMILES for (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol is Cc1cccc(COc2ccc([C@H](C)O)c(F)c2)n1.
What is the InChIKey of (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
The InChIKey is FRBIOPZFYOSELO-NSHDSACASA-N. The full InChI is InChI=1S/C15H16FNO2/c1-10-4-3-5-12(17-10)9-19-13-6-7-14(11(2)18)15(16)8-13/h3-8,11,18H,9H2,1-2H3/t11-/m0/s1.
What are the key properties of (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
(1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol has a molecular weight of 261.30 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[2-fluoro-4-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 107720712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).