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

C17H14FNO2 — CID 115956404

IUPAC[3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol
SMILESOCc1cccc(F)c1OCc1ccc2ccccc2n1
InChIInChI=1S/C17H14FNO2/c18-15-6-3-5-13(10-20)17(15)21-11-14-9-8-12-4-1-2-7-16(12)19-14/h1-9,20H,10-11H2
InChIKeyKXKOIGRHEZLUPM-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.45
Rot. Bonds4

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

[3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol (PubChem CID 115956404) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol
PubChem CID115956404
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Name[3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol
SMILESOCc1cccc(F)c1OCc1ccc2ccccc2n1
InChIInChI=1S/C17H14FNO2/c18-15-6-3-5-13(10-20)17(15)21-11-14-9-8-12-4-1-2-7-16(12)19-14/h1-9,20H,10-11H2
InChIKeyKXKOIGRHEZLUPM-UHFFFAOYSA-N
XLogP3.45
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol
CID 112613122
4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol
CID 112613126
[2-[(2-chlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613091
[3-fluoro-2-(1,3-thiazol-2-ylmethoxy)phenyl]methanol
CID 112613201
2-[[4-fluoro-1-(quinolin-2-ylmethoxy)naphthalene-2-carbonyl]amino]-2-methylpropanoic acid
CID 11546509
3-[2-fluoro-6-(hydroxymethyl)phenoxy]propan-1-ol
CID 112612921
[3-fluoro-2-(phenylmethoxymethoxy)phenyl]methanol
CID 102939875
2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl]acetic acid
CID 22241469
2-[(4-chloro-3-fluorophenoxy)methyl]quinoline
CID 82727045
3-fluoro-4-(quinolin-2-ylmethyl)phenol
CID 83129838
[4-(quinolin-2-ylmethoxy)phenyl]methanamine
CID 28773235
(3-fluoro-2-heptoxyphenyl)methanol
CID 112612964

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol?
The IUPAC name of [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol (CID 115956404) is [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol.
What is the SMILES notation for [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol?
The canonical SMILES for [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol is OCc1cccc(F)c1OCc1ccc2ccccc2n1.
What is the InChIKey of [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol?
The InChIKey is KXKOIGRHEZLUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c18-15-6-3-5-13(10-20)17(15)21-11-14-9-8-12-4-1-2-7-16(12)19-14/h1-9,20H,10-11H2.
What are the key properties of [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol?
[3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol has a molecular weight of 283.30 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol is sourced from PubChem (CID 115956404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).