2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide

C15H18N6O3 — CID 122301399

IUPAC2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide
SMILESCc1nc(C)n(-c2ncc(NC(=O)CN3CCOC3=O)cn2)c1C
InChIInChI=1S/C15H18N6O3/c1-9-10(2)21(11(3)18-9)14-16-6-12(7-17-14)19-13(22)8-20-4-5-24-15(20)23/h6-7H,4-5,8H2,1-3H3,(H,19,22)
InChIKeyYMHOVLPZALMRMD-UHFFFAOYSA-N
MW330.35 g/mol
LogP0.98
Rot. Bonds4

About 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide

2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide (PubChem CID 122301399) has the molecular formula C15H18N6O3 and a molecular weight of 330.35 g/mol. Its IUPAC name is 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide.

Molecular Properties

Compound Name2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide
PubChem CID122301399
Molecular FormulaC15H18N6O3
Molecular Weight330.35 g/mol
Exact Mass330.14
IUPAC Name2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide
SMILESCc1nc(C)n(-c2ncc(NC(=O)CN3CCOC3=O)cn2)c1C
InChIInChI=1S/C15H18N6O3/c1-9-10(2)21(11(3)18-9)14-16-6-12(7-17-14)19-13(22)8-20-4-5-24-15(20)23/h6-7H,4-5,8H2,1-3H3,(H,19,22)
InChIKeyYMHOVLPZALMRMD-UHFFFAOYSA-N
XLogP0.98
TPSA102.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide?
The IUPAC name of 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide (CID 122301399) is 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide.
What is the SMILES notation for 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide?
The canonical SMILES for 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide is Cc1nc(C)n(-c2ncc(NC(=O)CN3CCOC3=O)cn2)c1C.
What is the InChIKey of 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide?
The InChIKey is YMHOVLPZALMRMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O3/c1-9-10(2)21(11(3)18-9)14-16-6-12(7-17-14)19-13(22)8-20-4-5-24-15(20)23/h6-7H,4-5,8H2,1-3H3,(H,19,22).
What are the key properties of 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide?
2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide has a molecular weight of 330.35 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1,3-oxazolidin-3-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide is sourced from PubChem (CID 122301399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).