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

C12H14N4O2 — CID 113339620

IUPAC5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide
SMILESCC(NC(=O)c1cc(C2CC2)on1)c1cn[nH]c1
InChIInChI=1S/C12H14N4O2/c1-7(9-5-13-14-6-9)15-12(17)10-4-11(18-16-10)8-2-3-8/h4-8H,2-3H2,1H3,(H,13,14)(H,15,17)
InChIKeyOCVFWXFAVVUIBN-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.77
Rot. Bonds4

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

5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide (PubChem CID 113339620) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide
PubChem CID113339620
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide
SMILESCC(NC(=O)c1cc(C2CC2)on1)c1cn[nH]c1
InChIInChI=1S/C12H14N4O2/c1-7(9-5-13-14-6-9)15-12(17)10-4-11(18-16-10)8-2-3-8/h4-8H,2-3H2,1H3,(H,13,14)(H,15,17)
InChIKeyOCVFWXFAVVUIBN-UHFFFAOYSA-N
XLogP1.77
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 6621450
5-cyclopropyl-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-1,2-oxazole-3-carboxamide
CID 42940487
4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 106208104
2-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]butanoic acid
CID 43469491
5-cyclopropyl-N-(1-hydroxy-4-methoxybutan-2-yl)-1,2-oxazole-3-carboxamide
CID 114211248
5-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-3-carboxamide
CID 113236978
3-phenyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-5-carboxamide
CID 103856479
4-[1-(1H-pyrazol-4-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 114159493
3-(cyclopropylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
CID 106212808
N-[1-(4-chlorophenyl)-2,2-dimethylpropyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide
CID 130187969
N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-carboxamide
CID 103855985
5-fluoro-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-carboxamide
CID 113339663

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide (CID 113339620) is 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide is CC(NC(=O)c1cc(C2CC2)on1)c1cn[nH]c1.
What is the InChIKey of 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is OCVFWXFAVVUIBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-7(9-5-13-14-6-9)15-12(17)10-4-11(18-16-10)8-2-3-8/h4-8H,2-3H2,1H3,(H,13,14)(H,15,17).
What are the key properties of 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 113339620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).