2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide

C13H13N3O3 — CID 21089070

IUPAC2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide
SMILESNC(=O)Cn1cnc(OCc2ccccc2)cc1=O
InChIInChI=1S/C13H13N3O3/c14-11(17)7-16-9-15-12(6-13(16)18)19-8-10-4-2-1-3-5-10/h1-6,9H,7-8H2,(H2,14,17)
InChIKeySKSZSUSSIZJPEF-UHFFFAOYSA-N
MW259.27 g/mol
LogP0.31
Rot. Bonds5

About 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide

2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide (PubChem CID 21089070) has the molecular formula C13H13N3O3 and a molecular weight of 259.27 g/mol. Its IUPAC name is 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide.

Molecular Properties

Compound Name2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide
PubChem CID21089070
Molecular FormulaC13H13N3O3
Molecular Weight259.27 g/mol
Exact Mass259.10
IUPAC Name2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide
SMILESNC(=O)Cn1cnc(OCc2ccccc2)cc1=O
InChIInChI=1S/C13H13N3O3/c14-11(17)7-16-9-15-12(6-13(16)18)19-8-10-4-2-1-3-5-10/h1-6,9H,7-8H2,(H2,14,17)
InChIKeySKSZSUSSIZJPEF-UHFFFAOYSA-N
XLogP0.31
TPSA87.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.27
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-[4-(hydroxymethyl)phenyl]-2-oxoethyl]-6-phenylmethoxypyrimidin-4-one
CID 67007502
3-[(4-fluorophenyl)methyl]-6-phenylmethoxypyrimidin-4-one
CID 21090110
2-(6-oxo-4-phenylpyrimidin-1-yl)-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 121063676
2-[4-(4-ethoxyphenyl)-6-oxopyrimidin-1-yl]-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 121063810
(1-benzyl-6-oxopyrimidin-4-yl) methanesulfonate
CID 87537907
1-[2-[5-(aminomethyl)-2-pyridinyl]-2-oxoethyl]-4-phenylmethoxypyridin-2-one
CID 143850273
3,6-bis(phenylmethoxy)pyridazine
CID 68982842
benzyl 2-[4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-oxo-1-pyridinyl]acetate
CID 146309670
2-(4-methyl-6-oxopyrimidin-1-yl)-N-(3-phenylpropyl)acetamide
CID 121064050
benzyl 4-(benzimidazol-1-yl)butanoate
CID 154459478
3-benzyl-2-methyl-6-phenylmethoxypyrimidin-4-one;ethane
CID 91343480
benzyl 2-(8-methyl-4-oxoquinazolin-3-yl)acetate
CID 27938253

Frequently Asked Questions

What is the IUPAC name of 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide?
The IUPAC name of 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide (CID 21089070) is 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide.
What is the SMILES notation for 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide?
The canonical SMILES for 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide is NC(=O)Cn1cnc(OCc2ccccc2)cc1=O.
What is the InChIKey of 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide?
The InChIKey is SKSZSUSSIZJPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3/c14-11(17)7-16-9-15-12(6-13(16)18)19-8-10-4-2-1-3-5-10/h1-6,9H,7-8H2,(H2,14,17).
What are the key properties of 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide?
2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide has a molecular weight of 259.27 g/mol, XLogP of 0.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-oxo-4-phenylmethoxypyrimidin-1-yl)acetamide is sourced from PubChem (CID 21089070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).