(3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone

C13H8Cl2FNO — CID 79786089

IUPAC(3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone
SMILESCc1ccc(F)c(C(=O)c2ncc(Cl)cc2Cl)c1
InChIInChI=1S/C13H8Cl2FNO/c1-7-2-3-11(16)9(4-7)13(18)12-10(15)5-8(14)6-17-12/h2-6H,1H3
InChIKeyZVARDRCUKSAUNZ-UHFFFAOYSA-N
MW284.12 g/mol
LogP4.07
Rot. Bonds2

About (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone

(3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone (PubChem CID 79786089) has the molecular formula C13H8Cl2FNO and a molecular weight of 284.12 g/mol. Its IUPAC name is (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone.

Molecular Properties

Compound Name(3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone
PubChem CID79786089
Molecular FormulaC13H8Cl2FNO
Molecular Weight284.12 g/mol
Exact Mass283.00
IUPAC Name(3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone
SMILESCc1ccc(F)c(C(=O)c2ncc(Cl)cc2Cl)c1
InChIInChI=1S/C13H8Cl2FNO/c1-7-2-3-11(16)9(4-7)13(18)12-10(15)5-8(14)6-17-12/h2-6H,1H3
InChIKeyZVARDRCUKSAUNZ-UHFFFAOYSA-N
XLogP4.07
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.12
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-4,5-difluorophenyl)-(2-fluoro-5-methylphenyl)methanone
CID 107475658
(3,5-dichloro-2-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 82807772
(3,5-dichloro-2-pyridinyl)-(5-methylthiophen-2-yl)methanone
CID 79787027
(4-bromo-3-chlorophenyl)-(2-fluoro-5-methylphenyl)methanone
CID 114970869
1-(3,5-dichloro-2-pyridinyl)-2-(4-fluoro-3-methylphenyl)ethanone
CID 160693178
(4-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-(2-fluoro-5-methylphenyl)methanone
CID 115512690
ethane;2-fluoro-5-methylbenzoyl chloride
CID 143991429
N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 79770805
(1,5-dimethylpyrazol-4-yl)-(2-fluoro-5-methylphenyl)methanone
CID 105096035
2,2,2-trifluoro-1-(2-fluoro-5-methylphenyl)ethanone
CID 62961335
1-(3,5-dichloro-2-pyridinyl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 114347309
N-(6-chloro-5-methyl-3-pyridinyl)-2-fluoro-5-methylbenzamide
CID 113250442

Frequently Asked Questions

What is the IUPAC name of (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone?
The IUPAC name of (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone (CID 79786089) is (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone.
What is the SMILES notation for (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone?
The canonical SMILES for (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone is Cc1ccc(F)c(C(=O)c2ncc(Cl)cc2Cl)c1.
What is the InChIKey of (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone?
The InChIKey is ZVARDRCUKSAUNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2FNO/c1-7-2-3-11(16)9(4-7)13(18)12-10(15)5-8(14)6-17-12/h2-6H,1H3.
What are the key properties of (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone?
(3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone has a molecular weight of 284.12 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-2-pyridinyl)-(2-fluoro-5-methylphenyl)methanone is sourced from PubChem (CID 79786089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).