5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide

C12H14N4O2 — CID 60574068

IUPAC5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C3CC3)on2)n(C)n1
InChIInChI=1S/C12H14N4O2/c1-7-5-11(16(2)14-7)13-12(17)9-6-10(18-15-9)8-3-4-8/h5-6,8H,3-4H2,1-2H3,(H,13,17)
InChIKeyVKZHORUUDNSPAL-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.85
Rot. Bonds3

About 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide (PubChem CID 60574068) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
PubChem CID60574068
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C3CC3)on2)n(C)n1
InChIInChI=1S/C12H14N4O2/c1-7-5-11(16(2)14-7)13-12(17)9-6-10(18-15-9)8-3-4-8/h5-6,8H,3-4H2,1-2H3,(H,13,17)
InChIKeyVKZHORUUDNSPAL-UHFFFAOYSA-N
XLogP1.85
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-N,5-N-bis(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3,5-dicarboxamide
CID 29097376
5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide
CID 113236978
5-cyclopropyl-N-(4,5-dimethyl-1H-pyrazol-3-yl)-1,2-oxazole-3-carboxamide
CID 112689333
N-(3-chloro-2-methylphenyl)-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 5308825
5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide
CID 154774184
5-cyclopropyl-N-(4-oxo-1H-pyridin-3-yl)-1,2-oxazole-3-carboxamide
CID 71937067
bis(5-cyclopropyl-1,2-oxazol-3-yl)methanone
CID 175316695
5-cyclopropyl-N-[(3S,4S)-1,4-dimethylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130395208
1-cyclopropyl-3-(2,5-dimethylpyrazol-3-yl)urea
CID 115581841
1-(5-cyclopropyl-1,2-oxazol-3-yl)ethanone;ethane
CID 178176268
5-cyclopropyl-N-(1-ethyl-6-oxo-3-pyridinyl)-1,2-oxazole-3-carboxamide
CID 146323310
5-cyclopropyl-N-(1,2-dimethylpiperidin-3-yl)-1,2-oxazole-3-carboxamide
CID 130188089

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide (CID 60574068) is 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide is Cc1cc(NC(=O)c2cc(C3CC3)on2)n(C)n1.
What is the InChIKey of 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is VKZHORUUDNSPAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-7-5-11(16(2)14-7)13-12(17)9-6-10(18-15-9)8-3-4-8/h5-6,8H,3-4H2,1-2H3,(H,13,17).
What are the key properties of 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 60574068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).