N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide

C14H14N6O2 — CID 122301289

IUPACN-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide
SMILESCc1nc(C)n(-c2ncc(NC(=O)c3ccno3)cn2)c1C
InChIInChI=1S/C14H14N6O2/c1-8-9(2)20(10(3)18-8)14-15-6-11(7-16-14)19-13(21)12-4-5-17-22-12/h4-7H,1-3H3,(H,19,21)
InChIKeyHWRLBFNPAAEOTL-UHFFFAOYSA-N
MW298.31 g/mol
LogP1.83
Rot. Bonds3

About N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide

N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide (PubChem CID 122301289) has the molecular formula C14H14N6O2 and a molecular weight of 298.31 g/mol. Its IUPAC name is N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide
PubChem CID122301289
Molecular FormulaC14H14N6O2
Molecular Weight298.31 g/mol
Exact Mass298.12
IUPAC NameN-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide
SMILESCc1nc(C)n(-c2ncc(NC(=O)c3ccno3)cn2)c1C
InChIInChI=1S/C14H14N6O2/c1-8-9(2)20(10(3)18-8)14-15-6-11(7-16-14)19-13(21)12-4-5-17-22-12/h4-7H,1-3H3,(H,19,21)
InChIKeyHWRLBFNPAAEOTL-UHFFFAOYSA-N
XLogP1.83
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.31
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]pyridine-2-carboxamide
CID 122301228
N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]pyridine-3-carboxamide
CID 122301229
2-methyl-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]benzamide
CID 122301170
2-bromo-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]benzamide
CID 122301454
5-pyridin-3-yl-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide
CID 122301419
4-methyl-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,3-thiazole-5-carboxamide
CID 122301424
2-methoxy-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]pyridine-4-carboxamide
CID 122301434
2,4-dichloro-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]benzamide
CID 122301191
3-fluoro-4-methoxy-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]benzamide
CID 122301377
3,4,5-trimethoxy-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]benzamide
CID 122301183
1-(2,5-difluorophenyl)-3-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]urea
CID 122301272
(E)-3-(furan-2-yl)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]prop-2-enamide
CID 122301225

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide (CID 122301289) is N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide is Cc1nc(C)n(-c2ncc(NC(=O)c3ccno3)cn2)c1C.
What is the InChIKey of N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide?
The InChIKey is HWRLBFNPAAEOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6O2/c1-8-9(2)20(10(3)18-8)14-15-6-11(7-16-14)19-13(21)12-4-5-17-22-12/h4-7H,1-3H3,(H,19,21).
What are the key properties of N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide?
N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide has a molecular weight of 298.31 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 122301289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).