2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide

C14H13BrFN3O2 — CID 104505886

IUPAC2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide
SMILESCc1c(N)cn(CC(=O)Nc2cccc(F)c2)c(=O)c1Br
InChIInChI=1S/C14H13BrFN3O2/c1-8-11(17)6-19(14(21)13(8)15)7-12(20)18-10-4-2-3-9(16)5-10/h2-6H,7,17H2,1H3,(H,18,20)
InChIKeyCKAVHHFEVOPQMS-UHFFFAOYSA-N
MW354.18 g/mol
LogP2.28
Rot. Bonds3

About 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide

2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide (PubChem CID 104505886) has the molecular formula C14H13BrFN3O2 and a molecular weight of 354.18 g/mol. Its IUPAC name is 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide
PubChem CID104505886
Molecular FormulaC14H13BrFN3O2
Molecular Weight354.18 g/mol
Exact Mass353.02
IUPAC Name2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide
SMILESCc1c(N)cn(CC(=O)Nc2cccc(F)c2)c(=O)c1Br
InChIInChI=1S/C14H13BrFN3O2/c1-8-11(17)6-19(14(21)13(8)15)7-12(20)18-10-4-2-3-9(16)5-10/h2-6H,7,17H2,1H3,(H,18,20)
InChIKeyCKAVHHFEVOPQMS-UHFFFAOYSA-N
XLogP2.28
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.18
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-fluorophenyl)acetamide
CID 104505678
2-(4,5-dimethylimidazol-1-yl)-N-(3-fluorophenyl)acetamide
CID 115616714
2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylphenyl)acetamide
CID 79354801
2-(3-amino-2-methylphenyl)sulfanyl-N-(3-fluorophenyl)acetamide
CID 79144177
N'-(4-bromo-3-methylphenyl)-N-(3-fluorophenyl)propanediamide
CID 108956592
N-(3-fluorophenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679426
2-(2-amino-5-bromophenyl)sulfanyl-N-(3-fluorophenyl)acetamide
CID 79533619
N-(3-fluorophenyl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396043
2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide
CID 26579576
N-(3-fluorophenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 9067963
N-(3-fluorophenyl)-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide
CID 115774438
2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide
CID 121064421

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide (CID 104505886) is 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide is Cc1c(N)cn(CC(=O)Nc2cccc(F)c2)c(=O)c1Br.
What is the InChIKey of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
The InChIKey is CKAVHHFEVOPQMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrFN3O2/c1-8-11(17)6-19(14(21)13(8)15)7-12(20)18-10-4-2-3-9(16)5-10/h2-6H,7,17H2,1H3,(H,18,20).
What are the key properties of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide has a molecular weight of 354.18 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 104505886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).