2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide

C18H15N3O2 — CID 17407421

IUPAC2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide
SMILESO=C(COc1ccccc1)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C18H15N3O2/c22-17(13-23-16-9-5-2-6-10-16)21-15-11-19-18(20-12-15)14-7-3-1-4-8-14/h1-12H,13H2,(H,21,22)
InChIKeyVPBXGKXEQIEMHN-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.16
Rot. Bonds5

About 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide

2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide (PubChem CID 17407421) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide
PubChem CID17407421
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide
SMILESO=C(COc1ccccc1)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C18H15N3O2/c22-17(13-23-16-9-5-2-6-10-16)21-15-11-19-18(20-12-15)14-7-3-1-4-8-14/h1-12H,13H2,(H,21,22)
InChIKeyVPBXGKXEQIEMHN-UHFFFAOYSA-N
XLogP3.16
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-phenylpyrimidin-5-yl)propanamide
CID 53014772
2-chloro-N-(2-phenylpyrimidin-5-yl)acetamide
CID 43699755
N-(6-fluoro-3-pyridinyl)-2-phenoxyacetamide
CID 103789815
2-methylsulfanyl-N-(2-phenylpyrimidin-5-yl)acetamide
CID 47128547
N-(4-acetamidophenyl)-2-phenoxyacetamide
CID 675023
N-(2-bromo-4-methylphenyl)-2-(2-phenylpyrimidin-5-yl)oxyacetamide
CID 39009374
N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide
CID 4511463
2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]-N-pyridin-3-ylacetamide
CID 46266764
4-(2-anilino-2-oxoethoxy)-N-phenylbenzamide
CID 10545541
N-(2-anilinophenyl)-2-phenoxyacetamide
CID 23903366
3-[(2-phenoxyacetyl)amino]benzamide
CID 910367
2,2-dimethyl-N-[2-oxo-2-[(2-phenylpyrimidin-5-yl)amino]ethyl]propanamide
CID 134009428

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide?
The IUPAC name of 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide (CID 17407421) is 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide?
The canonical SMILES for 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide is O=C(COc1ccccc1)Nc1cnc(-c2ccccc2)nc1.
What is the InChIKey of 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide?
The InChIKey is VPBXGKXEQIEMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-17(13-23-16-9-5-2-6-10-16)21-15-11-19-18(20-12-15)14-7-3-1-4-8-14/h1-12H,13H2,(H,21,22).
What are the key properties of 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide?
2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide has a molecular weight of 305.34 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide is sourced from PubChem (CID 17407421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).