5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide

C15H15F3N4O2 — CID 71797005

IUPAC5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(F)(F)F)nc(CCNC(=O)c2cc(C3CC3)on2)n1
InChIInChI=1S/C15H15F3N4O2/c1-8-6-12(15(16,17)18)21-13(20-8)4-5-19-14(23)10-7-11(24-22-10)9-2-3-9/h6-7,9H,2-5H2,1H3,(H,19,23)
InChIKeyKNQYRIXTZUTMKB-UHFFFAOYSA-N
MW340.31 g/mol
LogP2.64
Rot. Bonds5

About 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide (PubChem CID 71797005) has the molecular formula C15H15F3N4O2 and a molecular weight of 340.31 g/mol. Its IUPAC name is 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide
PubChem CID71797005
Molecular FormulaC15H15F3N4O2
Molecular Weight340.31 g/mol
Exact Mass340.11
IUPAC Name5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(F)(F)F)nc(CCNC(=O)c2cc(C3CC3)on2)n1
InChIInChI=1S/C15H15F3N4O2/c1-8-6-12(15(16,17)18)21-13(20-8)4-5-19-14(23)10-7-11(24-22-10)9-2-3-9/h6-7,9H,2-5H2,1H3,(H,19,23)
InChIKeyKNQYRIXTZUTMKB-UHFFFAOYSA-N
XLogP2.64
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.31
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide (CID 71797005) is 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide is Cc1cc(C(F)(F)F)nc(CCNC(=O)c2cc(C3CC3)on2)n1.
What is the InChIKey of 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is KNQYRIXTZUTMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N4O2/c1-8-6-12(15(16,17)18)21-13(20-8)4-5-19-14(23)10-7-11(24-22-10)9-2-3-9/h6-7,9H,2-5H2,1H3,(H,19,23).
What are the key properties of 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 340.31 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 71797005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).