N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide

C9H8N4O2 — CID 91803234

IUPACN-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide
SMILESCc1nccc(NC(=O)c2cnco2)n1
InChIInChI=1S/C9H8N4O2/c1-6-11-3-2-8(12-6)13-9(14)7-4-10-5-15-7/h2-5H,1H3,(H,11,12,13,14)
InChIKeyVEPCFJRWYIBWPU-UHFFFAOYSA-N
MW204.19 g/mol
LogP1.03
Rot. Bonds2

About N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide

N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide (PubChem CID 91803234) has the molecular formula C9H8N4O2 and a molecular weight of 204.19 g/mol. Its IUPAC name is N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide
PubChem CID91803234
Molecular FormulaC9H8N4O2
Molecular Weight204.19 g/mol
Exact Mass204.06
IUPAC NameN-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide
SMILESCc1nccc(NC(=O)c2cnco2)n1
InChIInChI=1S/C9H8N4O2/c1-6-11-3-2-8(12-6)13-9(14)7-4-10-5-15-7/h2-5H,1H3,(H,11,12,13,14)
InChIKeyVEPCFJRWYIBWPU-UHFFFAOYSA-N
XLogP1.03
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide (CID 91803234) is N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide is Cc1nccc(NC(=O)c2cnco2)n1.
What is the InChIKey of N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide?
The InChIKey is VEPCFJRWYIBWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4O2/c1-6-11-3-2-8(12-6)13-9(14)7-4-10-5-15-7/h2-5H,1H3,(H,11,12,13,14).
What are the key properties of N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide?
N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide has a molecular weight of 204.19 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpyrimidin-4-yl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 91803234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).