(2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol

C12H9ClFNO — CID 62945841

IUPAC(2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol
SMILESOC(c1cccnc1)c1ccc(F)cc1Cl
InChIInChI=1S/C12H9ClFNO/c13-11-6-9(14)3-4-10(11)12(16)8-2-1-5-15-7-8/h1-7,12,16H
InChIKeyIZUOJONLJZIUQH-UHFFFAOYSA-N
MW237.66 g/mol
LogP2.96
Rot. Bonds2

About (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol

(2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol (PubChem CID 62945841) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol
PubChem CID62945841
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC Name(2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol
SMILESOC(c1cccnc1)c1ccc(F)cc1Cl
InChIInChI=1S/C12H9ClFNO/c13-11-6-9(14)3-4-10(11)12(16)8-2-1-5-15-7-8/h1-7,12,16H
InChIKeyIZUOJONLJZIUQH-UHFFFAOYSA-N
XLogP2.96
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.66
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5-fluoro-2-methylphenyl)-pyridin-3-ylmethanol
CID 62388574
N-[1-(2-chloro-4-fluorophenyl)ethyl]-1-pyridin-3-ylethanamine
CID 43768143
(2-chloro-4-fluorophenyl)-quinolin-6-ylmethanol
CID 81220584
(R)-(2-fluoro-3-pyridinyl)-pyridin-3-ylmethanol
CID 86334771
(3,5-dichlorophenyl)-pyridin-3-ylmethanol
CID 63900537
[5-(2-chloro-4-fluorophenyl)-3-(2,4-difluorophenyl)-1,2-oxazol-4-yl]-pyridin-3-ylmethanol
CID 58463288
[2-(4-fluorophenyl)furan-3-yl]-pyridin-3-ylmethanol
CID 91407319
(1S)-1-(2-chloro-4-fluorophenyl)-2-(5-pyridin-3-ylpyrazol-1-yl)ethanol
CID 124617810
(2-chloro-4-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 55152989
(2-chloro-3-methylphenyl)-pyridin-3-ylmethanol
CID 114980240
5-chloro-7-[hydroxy(pyridin-3-yl)methyl]quinolin-8-ol
CID 146026296
(2-chloro-4-fluorophenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089185

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol?
The IUPAC name of (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol (CID 62945841) is (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol.
What is the SMILES notation for (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol?
The canonical SMILES for (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol is OC(c1cccnc1)c1ccc(F)cc1Cl.
What is the InChIKey of (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol?
The InChIKey is IZUOJONLJZIUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c13-11-6-9(14)3-4-10(11)12(16)8-2-1-5-15-7-8/h1-7,12,16H.
What are the key properties of (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol?
(2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol has a molecular weight of 237.66 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 62945841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).