2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide

C14H14FN3O2 — CID 7748871

IUPAC2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2ccccc2F)c(C)n1
InChIInChI=1S/C14H14FN3O2/c1-9-7-14(20)18(10(2)16-9)8-13(19)17-12-6-4-3-5-11(12)15/h3-7H,8H2,1-2H3,(H,17,19)
InChIKeyNWAWYXNWLVKIPT-UHFFFAOYSA-N
MW275.28 g/mol
LogP1.64
Rot. Bonds3

About 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide

2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide (PubChem CID 7748871) has the molecular formula C14H14FN3O2 and a molecular weight of 275.28 g/mol. Its IUPAC name is 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide
PubChem CID7748871
Molecular FormulaC14H14FN3O2
Molecular Weight275.28 g/mol
Exact Mass275.11
IUPAC Name2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2ccccc2F)c(C)n1
InChIInChI=1S/C14H14FN3O2/c1-9-7-14(20)18(10(2)16-9)8-13(19)17-12-6-4-3-5-11(12)15/h3-7H,8H2,1-2H3,(H,17,19)
InChIKeyNWAWYXNWLVKIPT-UHFFFAOYSA-N
XLogP1.64
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(2-fluorophenyl)-2-oxoethyl]-2,6-dimethylpyrimidin-4-one
CID 63768337
N-(2-fluorophenyl)-2-(5-iodo-2-methyl-6-oxopyrimidin-1-yl)acetamide
CID 66340046
2-(2-amino-4-methyl-6-oxopyrimidin-1-yl)-N-(2-ethylphenyl)acetamide
CID 53201648
N-(3-fluoro-4-methylphenyl)-2-(4-methyl-6-oxo-2-phenylpyrimidin-1-yl)acetamide
CID 91887493
N-(3-cyanophenyl)-2-(2,4-dimethyl-6-oxopyrimidin-1-yl)acetamide
CID 63768495
2-(2-methyl-6-oxo-4-phenylpyrimidin-1-yl)-N-naphthalen-1-ylacetamide
CID 7747904
2,6-dimethyl-3-[2-(2-methylphenyl)-2-oxoethyl]pyrimidin-4-one
CID 63769710
methyl 3-[2-(2-fluoroanilino)-2-oxoethyl]-7-methyl-2,4-dioxo-1-phenylpyrido[2,3-d]pyrimidine-5-carboxylate
CID 17250660
N-(2-fluorophenyl)-2-(2-oxoquinoxalin-1-yl)acetamide
CID 8023095
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(2-fluorophenyl)acetamide
CID 40663166
ethyl 2-[[2-(4-methyl-2-methylsulfanyl-6-oxopyrimidin-1-yl)acetyl]amino]benzoate
CID 7748156
ethyl 4-[[2-(2,4-dimethyl-6-oxopyrimidin-1-yl)acetyl]amino]benzoate
CID 7748899

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide (CID 7748871) is 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide is Cc1cc(=O)n(CC(=O)Nc2ccccc2F)c(C)n1.
What is the InChIKey of 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide?
The InChIKey is NWAWYXNWLVKIPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O2/c1-9-7-14(20)18(10(2)16-9)8-13(19)17-12-6-4-3-5-11(12)15/h3-7H,8H2,1-2H3,(H,17,19).
What are the key properties of 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide?
2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide has a molecular weight of 275.28 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-6-oxopyrimidin-1-yl)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 7748871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).