[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol

C13H12FNO2 — CID 112613013

IUPAC[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol
SMILESOCc1cccc(F)c1OCc1ccccn1
InChIInChI=1S/C13H12FNO2/c14-12-6-3-4-10(8-16)13(12)17-9-11-5-1-2-7-15-11/h1-7,16H,8-9H2
InChIKeyGWZUKGWCLPNTBM-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.29
Rot. Bonds4

About [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol

[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol (PubChem CID 112613013) has the molecular formula C13H12FNO2 and a molecular weight of 233.24 g/mol. Its IUPAC name is [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol
PubChem CID112613013
Molecular FormulaC13H12FNO2
Molecular Weight233.24 g/mol
Exact Mass233.09
IUPAC Name[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol
SMILESOCc1cccc(F)c1OCc1ccccn1
InChIInChI=1S/C13H12FNO2/c14-12-6-3-4-10(8-16)13(12)17-9-11-5-1-2-7-15-11/h1-7,16H,8-9H2
InChIKeyGWZUKGWCLPNTBM-UHFFFAOYSA-N
XLogP2.29
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-methoxy-2-(pyridin-2-ylmethoxy)phenyl]methanol
CID 43471608
[3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol
CID 115956404
[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol
CID 112613122
[2-[(2-chlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613091
[3-fluoro-2-(1,3-thiazol-2-ylmethoxy)phenyl]methanol
CID 112613201
4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol
CID 112613126
(E)-3-[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]prop-2-enoic acid
CID 115956988
3-[2-fluoro-6-(hydroxymethyl)phenoxy]propan-1-ol
CID 112612921
[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methanol
CID 2987070
[3-fluoro-2-(phenylmethoxymethoxy)phenyl]methanol
CID 102939875
(3-fluoro-2-heptoxyphenyl)methanol
CID 112612964
[2-[(4-bromo-2-fluorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613188

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol?
The IUPAC name of [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol (CID 112613013) is [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol.
What is the SMILES notation for [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol?
The canonical SMILES for [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol is OCc1cccc(F)c1OCc1ccccn1.
What is the InChIKey of [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol?
The InChIKey is GWZUKGWCLPNTBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2/c14-12-6-3-4-10(8-16)13(12)17-9-11-5-1-2-7-15-11/h1-7,16H,8-9H2.
What are the key properties of [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol?
[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol has a molecular weight of 233.24 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol is sourced from PubChem (CID 112613013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).