5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide

C11H12N4O2 — CID 113236978

IUPAC5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cn[nH]c1NC(=O)c1cc(C2CC2)on1
InChIInChI=1S/C11H12N4O2/c1-6-5-12-14-10(6)13-11(16)8-4-9(17-15-8)7-2-3-7/h4-5,7H,2-3H2,1H3,(H2,12,13,14,16)
InChIKeyHTAPFIZHLFGHPZ-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.84
Rot. Bonds3

About 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide (PubChem CID 113236978) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide
PubChem CID113236978
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cn[nH]c1NC(=O)c1cc(C2CC2)on1
InChIInChI=1S/C11H12N4O2/c1-6-5-12-14-10(6)13-11(16)8-4-9(17-15-8)7-2-3-7/h4-5,7H,2-3H2,1H3,(H2,12,13,14,16)
InChIKeyHTAPFIZHLFGHPZ-UHFFFAOYSA-N
XLogP1.84
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide (CID 113236978) is 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide is Cc1cn[nH]c1NC(=O)c1cc(C2CC2)on1.
What is the InChIKey of 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is HTAPFIZHLFGHPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-6-5-12-14-10(6)13-11(16)8-4-9(17-15-8)7-2-3-7/h4-5,7H,2-3H2,1H3,(H2,12,13,14,16).
What are the key properties of 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 113236978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).