2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone

C14H11Cl2NO2 — CID 105088380

IUPAC2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone
SMILESCOc1ncccc1C(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H11Cl2NO2/c1-19-14-11(3-2-6-17-14)13(18)7-9-4-5-10(15)8-12(9)16/h2-6,8H,7H2,1H3
InChIKeyFXNPFDXYPINNAC-UHFFFAOYSA-N
MW296.15 g/mol
LogP3.82
Rot. Bonds4

About 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone

2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone (PubChem CID 105088380) has the molecular formula C14H11Cl2NO2 and a molecular weight of 296.15 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone
PubChem CID105088380
Molecular FormulaC14H11Cl2NO2
Molecular Weight296.15 g/mol
Exact Mass295.02
IUPAC Name2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone
SMILESCOc1ncccc1C(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H11Cl2NO2/c1-19-14-11(3-2-6-17-14)13(18)7-9-4-5-10(15)8-12(9)16/h2-6,8H,7H2,1H3
InChIKeyFXNPFDXYPINNAC-UHFFFAOYSA-N
XLogP3.82
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.15
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,4-dichlorophenyl)methyl]-2-methoxypyridin-3-amine
CID 43721777
2-(2-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethanone
CID 105078628
2-(3,4-dimethylphenyl)-1-(2-methoxy-3-pyridinyl)ethanone
CID 105083502
2-(2,4-dichlorophenoxy)pyridine-3-carbonyl chloride
CID 170944074
2-(2,5-dichlorophenyl)-1-(2-methyl-3-pyridinyl)ethanone
CID 105102625
2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethanone
CID 105079137
2-(4-bromothiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanone
CID 105092531
2-methoxy-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
CID 134062108
2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethanone
CID 105128260
1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanone
CID 105116343
1-(2-methoxy-3-pyridinyl)-4-methylpentan-1-one
CID 105087086
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-2-methoxy-N-propylpyridine-3-carboxamide
CID 134062156

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone?
The IUPAC name of 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone (CID 105088380) is 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone?
The canonical SMILES for 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone is COc1ncccc1C(=O)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone?
The InChIKey is FXNPFDXYPINNAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO2/c1-19-14-11(3-2-6-17-14)13(18)7-9-4-5-10(15)8-12(9)16/h2-6,8H,7H2,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone?
2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone has a molecular weight of 296.15 g/mol, XLogP of 3.82, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanone is sourced from PubChem (CID 105088380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).