5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol

C12H9ClFNO — CID 177205307

IUPAC5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol
SMILESCc1ccnc(-c2ccc(Cl)cc2O)c1F
InChIInChI=1S/C12H9ClFNO/c1-7-4-5-15-12(11(7)14)9-3-2-8(13)6-10(9)16/h2-6,16H,1H3
InChIKeyQIKAKEFNBZFKTP-UHFFFAOYSA-N
MW237.66 g/mol
LogP3.56
Rot. Bonds1

About 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol

5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol (PubChem CID 177205307) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol.

Molecular Properties

Compound Name5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol
PubChem CID177205307
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC Name5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol
SMILESCc1ccnc(-c2ccc(Cl)cc2O)c1F
InChIInChI=1S/C12H9ClFNO/c1-7-4-5-15-12(11(7)14)9-3-2-8(13)6-10(9)16/h2-6,16H,1H3
InChIKeyQIKAKEFNBZFKTP-UHFFFAOYSA-N
XLogP3.56
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.66
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chloro-2-fluorophenyl)pyridin-3-ol
CID 83130990
[2-(2,4-dichlorophenyl)-3-fluoro-4-pyridinyl]methanol
CID 118813716
4-methyl-2-(2,3,5-trichlorophenyl)pyridin-3-ol
CID 133092564
2-[2-(2,4-dichlorophenyl)-4-methyl-3-pyridinyl]acetic acid
CID 118853015
3-[amino-(5-chloro-2-fluorophenyl)methyl]-4-methylpyridin-2-amine
CID 114886010
5-chloro-2-(2,5-difluorophenyl)phenol
CID 146335926
5-chloro-2-(2-fluorophenyl)phenol
CID 46314337
2-chloro-3-(2,3-difluoro-4-methylphenyl)pyrazine
CID 107514509
3-(5-chloro-2-methylphenyl)-2,6-difluoroaniline
CID 165449932
5-chloro-2-(2,6-difluoro-3-methylphenyl)aniline
CID 82821994
1-[2-(3-chloro-2,4-difluorophenyl)-3-fluoro-4-pyridinyl]propan-2-one;ethane
CID 169264773
3-(4-chloro-3-fluoro-2-pyridinyl)-2-hydroxy-5-methylbenzaldehyde
CID 177366768

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol?
The IUPAC name of 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol (CID 177205307) is 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol.
What is the SMILES notation for 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol?
The canonical SMILES for 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol is Cc1ccnc(-c2ccc(Cl)cc2O)c1F.
What is the InChIKey of 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol?
The InChIKey is QIKAKEFNBZFKTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c1-7-4-5-15-12(11(7)14)9-3-2-8(13)6-10(9)16/h2-6,16H,1H3.
What are the key properties of 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol?
5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol has a molecular weight of 237.66 g/mol, XLogP of 3.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(3-fluoro-4-methyl-2-pyridinyl)phenol is sourced from PubChem (CID 177205307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).