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

C12H16N4O2 — CID 104619577

IUPAC3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
SMILESCCc1cc(NC(=O)c2c(CC)noc2C)n[nH]1
InChIInChI=1S/C12H16N4O2/c1-4-8-6-10(15-14-8)13-12(17)11-7(3)18-16-9(11)5-2/h6H,4-5H2,1-3H3,(H2,13,14,15,17)
InChIKeyVUTOLYVPGUKJNP-UHFFFAOYSA-N
MW248.29 g/mol
LogP2.08
Rot. Bonds4

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

3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide (PubChem CID 104619577) has the molecular formula C12H16N4O2 and a molecular weight of 248.29 g/mol. Its IUPAC name is 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
PubChem CID104619577
Molecular FormulaC12H16N4O2
Molecular Weight248.29 g/mol
Exact Mass248.13
IUPAC Name3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
SMILESCCc1cc(NC(=O)c2c(CC)noc2C)n[nH]1
InChIInChI=1S/C12H16N4O2/c1-4-8-6-10(15-14-8)13-12(17)11-7(3)18-16-9(11)5-2/h6H,4-5H2,1-3H3,(H2,13,14,15,17)
InChIKeyVUTOLYVPGUKJNP-UHFFFAOYSA-N
XLogP2.08
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,2-oxazole-4-carboxamide
CID 112691333
3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-6-methylpyridazine-4-carboxamide
CID 104625834
3-ethyl-N-(4-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 9040097
2,6-dichloro-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 113433751
2,4,5-trimethyl-N-(5-propyl-1H-pyrazol-3-yl)furan-3-carboxamide
CID 115621116
N-(5-ethyl-1H-pyrazol-3-yl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 115593805
N-(2,6-diethylphenyl)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 17173863
(5-ethyl-1H-pyrazol-3-yl)urea
CID 104620406
N-(5-ethyl-1H-pyrazol-3-yl)-2H-triazole-4-carboxamide
CID 47423483
2-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-5-methylthiophene-3-carboxylic acid
CID 63615998
N-(3-chloro-4-methylphenyl)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 9068463
N-(5-chloro-2-methylphenyl)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 17174120

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide (CID 104619577) is 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide is CCc1cc(NC(=O)c2c(CC)noc2C)n[nH]1.
What is the InChIKey of 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
The InChIKey is VUTOLYVPGUKJNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2/c1-4-8-6-10(15-14-8)13-12(17)11-7(3)18-16-9(11)5-2/h6H,4-5H2,1-3H3,(H2,13,14,15,17).
What are the key properties of 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide has a molecular weight of 248.29 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(5-ethyl-1H-pyrazol-3-yl)-5-methyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 104619577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).