6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one

C14H14BrNO2 — CID 160728651

IUPAC6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one
SMILESCCn1c(-c2ccc(OC)cc2Br)cccc1=O
InChIInChI=1S/C14H14BrNO2/c1-3-16-13(5-4-6-14(16)17)11-8-7-10(18-2)9-12(11)15/h4-9H,3H2,1-2H3
InChIKeyFRJDFNATBFCMOI-UHFFFAOYSA-N
MW308.18 g/mol
LogP3.31
Rot. Bonds3

About 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one

6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one (PubChem CID 160728651) has the molecular formula C14H14BrNO2 and a molecular weight of 308.18 g/mol. Its IUPAC name is 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one.

Molecular Properties

Compound Name6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one
PubChem CID160728651
Molecular FormulaC14H14BrNO2
Molecular Weight308.18 g/mol
Exact Mass307.02
IUPAC Name6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one
SMILESCCn1c(-c2ccc(OC)cc2Br)cccc1=O
InChIInChI=1S/C14H14BrNO2/c1-3-16-13(5-4-6-14(16)17)11-8-7-10(18-2)9-12(11)15/h4-9H,3H2,1-2H3
InChIKeyFRJDFNATBFCMOI-UHFFFAOYSA-N
XLogP3.31
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-[2-bromo-4-(methylsulfanylmethoxy)phenyl]-1-(2,2-difluoroethyl)pyridin-2-one
CID 160955775
6-[2-bromo-4-(methylsulfanylmethoxy)phenyl]-1-ethyl-3-methylpyridin-2-one
CID 148519544
6-(4-methoxy-2-methylphenyl)-1-methylpyridin-2-one
CID 118448854
6-(2-bromo-4-methoxyphenyl)-1-(2,2-difluoroethyl)-3-iodopyridin-2-one
CID 159368712
2-bromo-1-ethyl-4-methoxybenzene
CID 59138196
2-(2-bromo-4-methoxyphenyl)-3-methoxycycloprop-2-en-1-one
CID 11119117
3-bromo-6-(2-bromo-4-ethoxyphenyl)-1-(2,2-difluoroethyl)pyridin-2-one
CID 158124370
2-[1-ethyl-6-(3-methoxyphenyl)-2-oxo-3-pyridinyl]acetyl chloride
CID 82518551
2-[1-ethyl-6-(3-methoxyphenyl)-2-oxo-3-pyridinyl]acetonitrile
CID 82518561
3-ethyl-4-(3-methoxyphenyl)-1H-imidazol-2-one
CID 118668081
6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one
CID 4194648
3-bromo-1-ethyl-6-[4-(2-methoxyethoxy)-2-methylphenyl]pyridin-2-one
CID 160746316

Frequently Asked Questions

What is the IUPAC name of 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one?
The IUPAC name of 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one (CID 160728651) is 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one.
What is the SMILES notation for 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one?
The canonical SMILES for 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one is CCn1c(-c2ccc(OC)cc2Br)cccc1=O.
What is the InChIKey of 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one?
The InChIKey is FRJDFNATBFCMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO2/c1-3-16-13(5-4-6-14(16)17)11-8-7-10(18-2)9-12(11)15/h4-9H,3H2,1-2H3.
What are the key properties of 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one?
6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one has a molecular weight of 308.18 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-bromo-4-methoxyphenyl)-1-ethylpyridin-2-one is sourced from PubChem (CID 160728651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).