(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol

C13H12FNO — CID 23294400

IUPAC(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol
SMILESCc1ccc(C(O)c2ccncc2)c(F)c1
InChIInChI=1S/C13H12FNO/c1-9-2-3-11(12(14)8-9)13(16)10-4-6-15-7-5-10/h2-8,13,16H,1H3
InChIKeyPWNMNIDOZJZMOF-UHFFFAOYSA-N
MW217.24 g/mol
LogP2.61
Rot. Bonds2

About (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol

(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol (PubChem CID 23294400) has the molecular formula C13H12FNO and a molecular weight of 217.24 g/mol. Its IUPAC name is (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol.

Molecular Properties

Compound Name(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol
PubChem CID23294400
Molecular FormulaC13H12FNO
Molecular Weight217.24 g/mol
Exact Mass217.09
IUPAC Name(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol
SMILESCc1ccc(C(O)c2ccncc2)c(F)c1
InChIInChI=1S/C13H12FNO/c1-9-2-3-11(12(14)8-9)13(16)10-4-6-15-7-5-10/h2-8,13,16H,1H3
InChIKeyPWNMNIDOZJZMOF-UHFFFAOYSA-N
XLogP2.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.24
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-fluoro-4-methylphenyl)-(3-fluorophenyl)methanol
CID 114978479
(S)-(2-fluorophenyl)-pyridin-4-ylmethanol
CID 166771520
(2-fluoro-4-methylphenyl)methanediol
CID 129136979
(4-methylphenyl)-pyridin-4-ylmethanol
CID 3383504
(2-fluoro-4-methylphenyl)-naphthalen-2-ylmethanol
CID 115792718
(4-cyclopropyloxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115838353
(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol
CID 115826569
[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
CID 102751290
(2-fluoro-4-methylphenyl)-(5-propoxy-3-pyridinyl)methanol
CID 115829147
(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115827523
1-(2-fluoro-5-methylphenyl)-2-pyridin-4-ylpropan-1-one
CID 66470642
(2,4-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 62510487

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol?
The IUPAC name of (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol (CID 23294400) is (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol.
What is the SMILES notation for (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol?
The canonical SMILES for (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol is Cc1ccc(C(O)c2ccncc2)c(F)c1.
What is the InChIKey of (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol?
The InChIKey is PWNMNIDOZJZMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO/c1-9-2-3-11(12(14)8-9)13(16)10-4-6-15-7-5-10/h2-8,13,16H,1H3.
What are the key properties of (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol?
(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol has a molecular weight of 217.24 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol is sourced from PubChem (CID 23294400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).