[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol

C12H8Cl2FNO — CID 118813716

IUPAC[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol
SMILESOCc1ccnc(-c2ccc(Cl)cc2Cl)c1F
InChIInChI=1S/C12H8Cl2FNO/c13-8-1-2-9(10(14)5-8)12-11(15)7(6-17)3-4-16-12/h1-5,17H,6H2
InChIKeyLDFAXDXPDIFVMQ-UHFFFAOYSA-N
MW272.11 g/mol
LogP3.69
Rot. Bonds2

About [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol

[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol (PubChem CID 118813716) has the molecular formula C12H8Cl2FNO and a molecular weight of 272.11 g/mol. Its IUPAC name is [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol
PubChem CID118813716
Molecular FormulaC12H8Cl2FNO
Molecular Weight272.11 g/mol
Exact Mass271.00
IUPAC Name[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol
SMILESOCc1ccnc(-c2ccc(Cl)cc2Cl)c1F
InChIInChI=1S/C12H8Cl2FNO/c13-8-1-2-9(10(14)5-8)12-11(15)7(6-17)3-4-16-12/h1-5,17H,6H2
InChIKeyLDFAXDXPDIFVMQ-UHFFFAOYSA-N
XLogP3.69
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.11
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-chloro-2-(2,4-dichlorophenyl)-4-pyridinyl]acetic acid
CID 133088248
2-[3-amino-2-(2,4-dichlorophenyl)-4-pyridinyl]acetic acid
CID 133087191
[2-(2,4-dichlorophenyl)-5-fluorophenyl]methanol
CID 118807413
[3-chloro-2-(2,4,5-trichlorophenyl)-4-pyridinyl]methanol
CID 134625713
5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol
CID 177205307
2-(5-chloro-2,4-difluorophenyl)-4-ethyl-3-fluoropyridine
CID 170520352
[5-(2,5-dichlorophenyl)-2-fluorophenyl]methanol
CID 118824338
2-[2-(2,4-dichlorophenyl)-4-methyl-3-pyridinyl]acetic acid
CID 118853015
1-[2-(3-chloro-2,4-difluorophenyl)-3-fluoro-4-pyridinyl]propan-2-one;ethane
CID 169264773
2-[6-(2,4-dichlorophenyl)-3,5-difluoro-2-pyridinyl]acetic acid
CID 133091115
[5-chloro-2-(3,4-dichlorophenyl)phenyl]methanol
CID 71251754
[2-amino-3-(2,5-dichlorophenyl)-4-pyridinyl]methanol
CID 119005469

Frequently Asked Questions

What is the IUPAC name of [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol?
The IUPAC name of [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol (CID 118813716) is [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol.
What is the SMILES notation for [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol?
The canonical SMILES for [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol is OCc1ccnc(-c2ccc(Cl)cc2Cl)c1F.
What is the InChIKey of [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol?
The InChIKey is LDFAXDXPDIFVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2FNO/c13-8-1-2-9(10(14)5-8)12-11(15)7(6-17)3-4-16-12/h1-5,17H,6H2.
What are the key properties of [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol?
[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol has a molecular weight of 272.11 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol is sourced from PubChem (CID 118813716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).