[3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol

C14H15FN2O — CID 114067410

IUPAC[3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol
SMILESCN(Cc1cccnc1)c1c(F)cccc1CO
InChIInChI=1S/C14H15FN2O/c1-17(9-11-4-3-7-16-8-11)14-12(10-18)5-2-6-13(14)15/h2-8,18H,9-10H2,1H3
InChIKeyQDQJFRJVYVTEFM-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.35
Rot. Bonds4

About [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol

[3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol (PubChem CID 114067410) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol
PubChem CID114067410
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name[3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol
SMILESCN(Cc1cccnc1)c1c(F)cccc1CO
InChIInChI=1S/C14H15FN2O/c1-17(9-11-4-3-7-16-8-11)14-12(10-18)5-2-6-13(14)15/h2-8,18H,9-10H2,1H3
InChIKeyQDQJFRJVYVTEFM-UHFFFAOYSA-N
XLogP2.35
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(bromomethyl)-6-fluoro-N-methyl-N-(pyridin-3-ylmethyl)aniline
CID 114067675
[2-[methyl(pyridin-3-ylmethyl)amino]-3-pyridinyl]methanol
CID 61255832
1-[2-fluoro-6-[methyl(pyridin-3-ylmethyl)amino]phenyl]ethanol
CID 43563565
[6-[methyl(pyridin-3-ylmethyl)amino]-2-pyridinyl]methanol
CID 62254279
2-fluoro-6-[methyl(pyridin-3-ylmethyl)amino]benzonitrile
CID 78911103
1-(2-fluorophenyl)-3-[methyl(pyridin-3-ylmethyl)amino]propan-2-one
CID 62052978
[2-[methyl(pyridin-3-ylmethyl)amino]quinolin-4-yl]methanol
CID 61255834
[3-chloro-2-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol
CID 114067411
[3-fluoro-2-[methyl(oxan-4-ylmethyl)amino]phenyl]methanol
CID 114067505
N-methyl-N-(pyridin-3-ylmethyl)thiophen-2-amine
CID 154729661
N-methyl-2-pyridin-3-ylacetohydrazide
CID 116844877
3-(2-fluorophenyl)-2-N,2-dimethyl-2-N-(pyridin-3-ylmethyl)propane-1,2-diamine
CID 114831111

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol?
The IUPAC name of [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol (CID 114067410) is [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol.
What is the SMILES notation for [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol?
The canonical SMILES for [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol is CN(Cc1cccnc1)c1c(F)cccc1CO.
What is the InChIKey of [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol?
The InChIKey is QDQJFRJVYVTEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-17(9-11-4-3-7-16-8-11)14-12(10-18)5-2-6-13(14)15/h2-8,18H,9-10H2,1H3.
What are the key properties of [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol?
[3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol has a molecular weight of 246.28 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-2-[methyl(pyridin-3-ylmethyl)amino]phenyl]methanol is sourced from PubChem (CID 114067410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).