N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide

C20H19N3O3 — CID 122302706

IUPACN-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide
SMILESCOc1nc(C)c(NC(=O)c2ccccc2Oc2ccccc2)c(C)n1
InChIInChI=1S/C20H19N3O3/c1-13-18(14(2)22-20(21-13)25-3)23-19(24)16-11-7-8-12-17(16)26-15-9-5-4-6-10-15/h4-12H,1-3H3,(H,23,24)
InChIKeyVBRUWNJSHIJIRV-UHFFFAOYSA-N
MW349.39 g/mol
LogP4.15
Rot. Bonds5

About N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide

N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide (PubChem CID 122302706) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide.

Molecular Properties

Compound NameN-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide
PubChem CID122302706
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC NameN-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide
SMILESCOc1nc(C)c(NC(=O)c2ccccc2Oc2ccccc2)c(C)n1
InChIInChI=1S/C20H19N3O3/c1-13-18(14(2)22-20(21-13)25-3)23-19(24)16-11-7-8-12-17(16)26-15-9-5-4-6-10-15/h4-12H,1-3H3,(H,23,24)
InChIKeyVBRUWNJSHIJIRV-UHFFFAOYSA-N
XLogP4.15
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-(trifluoromethyl)benzamide
CID 121137096
N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-nitrobenzamide
CID 122302915
N-(4,6-dimethyl-2-phenoxypyrimidin-5-yl)-3,4,5-trimethoxybenzamide
CID 122303589
N-(4,6-dimethyl-2-phenoxypyrimidin-5-yl)-2,5-dimethylbenzamide
CID 122303609
2-phenoxy-N-phenylbenzamide
CID 3402306
3-(4-fluorophenoxy)-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzamide
CID 122302849
N-(2-methyl-1,3-benzoxazol-5-yl)-2-phenoxybenzamide
CID 30035454
N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-4-methylbenzamide
CID 91969122
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-phenoxybenzamide
CID 1346004
N-(4,6-dimethyl-2-phenoxypyrimidin-5-yl)-4-(trifluoromethyl)benzamide
CID 91969154
1-(4,6-dimethyl-2-phenoxypyrimidin-5-yl)-3-(3,4,5-trimethoxyphenyl)urea
CID 122303901
2-phenoxy-N-(4-phenylphenyl)benzamide
CID 7926007

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide?
The IUPAC name of N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide (CID 122302706) is N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide.
What is the SMILES notation for N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide?
The canonical SMILES for N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide is COc1nc(C)c(NC(=O)c2ccccc2Oc2ccccc2)c(C)n1.
What is the InChIKey of N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide?
The InChIKey is VBRUWNJSHIJIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-13-18(14(2)22-20(21-13)25-3)23-19(24)16-11-7-8-12-17(16)26-15-9-5-4-6-10-15/h4-12H,1-3H3,(H,23,24).
What are the key properties of N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide?
N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide has a molecular weight of 349.39 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-2-phenoxybenzamide is sourced from PubChem (CID 122302706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).