3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide

C11H15BrN2O2 — CID 83133302

IUPAC3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide
SMILESCCNC(=O)CCn1cc(Br)cc(C)c1=O
InChIInChI=1S/C11H15BrN2O2/c1-3-13-10(15)4-5-14-7-9(12)6-8(2)11(14)16/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyXTZGCXKGILJONV-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.45
Rot. Bonds4

About 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide

3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide (PubChem CID 83133302) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide.

Molecular Properties

Compound Name3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide
PubChem CID83133302
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide
SMILESCCNC(=O)CCn1cc(Br)cc(C)c1=O
InChIInChI=1S/C11H15BrN2O2/c1-3-13-10(15)4-5-14-7-9(12)6-8(2)11(14)16/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyXTZGCXKGILJONV-UHFFFAOYSA-N
XLogP1.45
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-methylbutanamide
CID 83133907
hydrazinyl 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)propanoate
CID 83133573
5-bromo-3-methyl-1-(3-methylbut-3-enyl)pyridin-2-one
CID 114476431
5-bromo-1-[2-(ethylamino)ethyl]-3-methylpyridin-2-one
CID 83130817
5-bromo-1-(4-bromobutyl)-3-methylpyridin-2-one
CID 83130815
5-bromo-3-methyl-1-(2-propoxyethyl)pyridin-2-one
CID 106455788
3-(5-bromo-7-methyl-2,3-dioxoindol-1-yl)-N-ethylpropanamide
CID 62325713
1-(2-aminooxyethyl)-5-bromo-3-methylpyridin-2-one
CID 131021073
5-bromo-3-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]pyridin-2-one
CID 83132882
5-bromo-1-[3-(ethylamino)-2-hydroxypropyl]-3-methylpyridin-2-one
CID 83131114
5-bromo-3-methyl-1-(2,2,2-trifluoroethyl)pyridin-2-one
CID 83133727
3-(4-bromo-2,6-dimethylanilino)-N-ethylpropanamide
CID 62324200

Frequently Asked Questions

What is the IUPAC name of 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide?
The IUPAC name of 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide (CID 83133302) is 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide.
What is the SMILES notation for 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide?
The canonical SMILES for 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide is CCNC(=O)CCn1cc(Br)cc(C)c1=O.
What is the InChIKey of 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide?
The InChIKey is XTZGCXKGILJONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c1-3-13-10(15)4-5-14-7-9(12)6-8(2)11(14)16/h6-7H,3-5H2,1-2H3,(H,13,15).
What are the key properties of 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide?
3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide has a molecular weight of 287.16 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-bromo-3-methyl-2-oxo-1-pyridinyl)-N-ethylpropanamide is sourced from PubChem (CID 83133302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).