[2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol

C12H9ClFNO — CID 56723042

IUPAC[2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol
SMILESOCc1ccnc(-c2ccc(F)cc2Cl)c1
InChIInChI=1S/C12H9ClFNO/c13-11-6-9(14)1-2-10(11)12-5-8(7-16)3-4-15-12/h1-6,16H,7H2
InChIKeyQQJVAGUCILFNRR-UHFFFAOYSA-N
MW237.66 g/mol
LogP3.03
Rot. Bonds2

About [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol

[2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol (PubChem CID 56723042) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol
PubChem CID56723042
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC Name[2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol
SMILESOCc1ccnc(-c2ccc(F)cc2Cl)c1
InChIInChI=1S/C12H9ClFNO/c13-11-6-9(14)1-2-10(11)12-5-8(7-16)3-4-15-12/h1-6,16H,7H2
InChIKeyQQJVAGUCILFNRR-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

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Related Compounds

alpha-Phenyl-4-pyridinemethanol
CID 98305
(4-Chlorophenyl)(pyridin-2-yl)methanol
CID 97719
Phenyl(pyridin-2-yl)methanol
CID 315585
(7R,9S)-7-((4-(2,6-dichlorophenyl)piperidin-1-yl)methyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
CID 24894426
4-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-methyl}benzenol
CID 2782995
(7R,9S)-7-(((3R,4R)-4-(2-chloro-4-fluorophenyl)-3-hydroxypiperidin-1-yl)methyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
CID 11188910
(-)-(3R,4R)-4-(2-Chloro-4-fluorophenyl)-3-hydroxy-1-{[(6R,8S)-8-hydroxy-5,6,7,8-tetrahydroquinolin-6-yl]methyl}piperidinium Chloride
CID 11326750
[4-[5-(3-Chloro-4-fluoroanilino)-3-pyridinyl]phenyl]methanol
CID 11580716
1-[2-(2-Chlorophenyl)-3-pyridinyl]-2,2-dipyridin-3-ylethanol
CID 16722242
(1S)-1-phenyl-2-(pyridin-2-yl)ethan-1-ol
CID 11310145
(4-Chlorophenyl)(pyridin-3-yl)methanol
CID 240724
1-(2-Chlorophenyl)-2-pyridin-4-ylethanol
CID 224943

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol?
The IUPAC name of [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol (CID 56723042) is [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol.
What is the SMILES notation for [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol?
The canonical SMILES for [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol is OCc1ccnc(-c2ccc(F)cc2Cl)c1.
What is the InChIKey of [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol?
The InChIKey is QQJVAGUCILFNRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c13-11-6-9(14)1-2-10(11)12-5-8(7-16)3-4-15-12/h1-6,16H,7H2.
What are the key properties of [2-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol?
[2-(2-chloro-4-fluorophenyl)-4-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-(2-chloro-4-fluorophenyl)-4-pyridinyl]methanol is sourced from PubChem (CID 56723042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).