[2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol

C12H9ClFNO — CID 119021722

IUPAC[2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol
SMILESOCc1cc(-c2ccccc2F)cnc1Cl
InChIInChI=1S/C12H9ClFNO/c13-12-9(7-16)5-8(6-15-12)10-3-1-2-4-11(10)14/h1-6,16H,7H2
InChIKeyXVFYIMJUNUJMQI-UHFFFAOYSA-N
MW237.66 g/mol
LogP3.03
Rot. Bonds2

About [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol

[2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol (PubChem CID 119021722) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol
PubChem CID119021722
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC Name[2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol
SMILESOCc1cc(-c2ccccc2F)cnc1Cl
InChIInChI=1S/C12H9ClFNO/c13-12-9(7-16)5-8(6-15-12)10-3-1-2-4-11(10)14/h1-6,16H,7H2
InChIKeyXVFYIMJUNUJMQI-UHFFFAOYSA-N
XLogP3.03
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 ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol 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

[2-chloro-5-(3,4-dichlorophenyl)-3-pyridinyl]methanol
CID 119006015
[2-chloro-5-(2,3,4,5,6-pentachlorophenyl)-3-pyridinyl]methanol
CID 134619774
2-[3,5-bis(2-fluorophenyl)-2-pyridinyl]acetic acid
CID 46314319
2-[5-(2-fluorophenyl)-3-methyl-2-pyridinyl]acetic acid
CID 46314277
1,4-bis(2-fluorophenyl)benzene
CID 58121760
[5-(2,5-dichlorophenyl)-2-fluorophenyl]methanol
CID 118824338
dichloromethane;1-fluoro-2-phenylbenzene
CID 174471910
[5-(2-fluorophenyl)-1,2-oxazol-4-yl]methanol
CID 115093787
[3-fluoro-2-(2-fluorophenyl)phenyl]methanol
CID 46312388
[4-chloro-2-(3-fluorophenyl)phenyl]methanol
CID 168865521
[5-(2-fluorophenyl)-2-pyridinyl]methylphosphonous acid
CID 71154994
2,3-dichloro-5-[2-(trifluoromethyl)phenyl]pyridine
CID 118815216

Frequently Asked Questions

What is the IUPAC name of [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol?
The IUPAC name of [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol (CID 119021722) is [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol.
What is the SMILES notation for [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol?
The canonical SMILES for [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol is OCc1cc(-c2ccccc2F)cnc1Cl.
What is the InChIKey of [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol?
The InChIKey is XVFYIMJUNUJMQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c13-12-9(7-16)5-8(6-15-12)10-3-1-2-4-11(10)14/h1-6,16H,7H2.
What are the key properties of [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol?
[2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol has a molecular weight of 237.66 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol is sourced from PubChem (CID 119021722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).