N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide

C15H14N4O2 — CID 3243507

IUPACN-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(-c2cn3cccnc3n2)cc1
InChIInChI=1S/C15H14N4O2/c1-21-10-14(20)17-12-5-3-11(4-6-12)13-9-19-8-2-7-16-15(19)18-13/h2-9H,10H2,1H3,(H,17,20)
InChIKeyXZAOMSOMLHFVOH-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.98
Rot. Bonds4

About N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide

N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide (PubChem CID 3243507) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide
PubChem CID3243507
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(-c2cn3cccnc3n2)cc1
InChIInChI=1S/C15H14N4O2/c1-21-10-14(20)17-12-5-3-11(4-6-12)13-9-19-8-2-7-16-15(19)18-13/h2-9H,10H2,1H3,(H,17,20)
InChIKeyXZAOMSOMLHFVOH-UHFFFAOYSA-N
XLogP1.98
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide?
The IUPAC name of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide (CID 3243507) is N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide.
What is the SMILES notation for N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide?
The canonical SMILES for N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide is COCC(=O)Nc1ccc(-c2cn3cccnc3n2)cc1.
What is the InChIKey of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide?
The InChIKey is XZAOMSOMLHFVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-21-10-14(20)17-12-5-3-11(4-6-12)13-9-19-8-2-7-16-15(19)18-13/h2-9H,10H2,1H3,(H,17,20).
What are the key properties of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide?
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide has a molecular weight of 282.30 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxyacetamide is sourced from PubChem (CID 3243507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).