4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine

C12H16N4O — CID 113439304

IUPAC4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine
SMILESCCc1nnc(C)cc1-c1noc(N)c1CC
InChIInChI=1S/C12H16N4O/c1-4-8-11(16-17-12(8)13)9-6-7(3)14-15-10(9)5-2/h6H,4-5,13H2,1-3H3
InChIKeyZOPUNEQWYDGZMR-UHFFFAOYSA-N
MW232.29 g/mol
LogP2.15
Rot. Bonds3

About 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine

4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine (PubChem CID 113439304) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine
PubChem CID113439304
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine
SMILESCCc1nnc(C)cc1-c1noc(N)c1CC
InChIInChI=1S/C12H16N4O/c1-4-8-11(16-17-12(8)13)9-6-7(3)14-15-10(9)5-2/h6H,4-5,13H2,1-3H3
InChIKeyZOPUNEQWYDGZMR-UHFFFAOYSA-N
XLogP2.15
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-amine
CID 104670086
4-ethyl-3-(2-methoxy-5-methylphenyl)-1,2-oxazol-5-amine
CID 62505793
3-(5-bromo-2-chlorophenyl)-4-ethyl-1,2-oxazol-5-amine
CID 43670956
4-ethyl-3-(2-methyl-5-nitrophenyl)-1,2-oxazol-5-amine
CID 61290377
4-ethyl-3-pyrimidin-5-yl-1,2-oxazol-5-amine
CID 102922020
3-(2,6-difluorophenyl)-4-ethyl-1,2-oxazol-5-amine
CID 43671006
4-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]phenol
CID 136905901
3-(2-chloro-3-fluorophenyl)-4-ethyl-1,2-oxazol-5-amine
CID 81454075
3-(2,5-difluoro-3-nitrophenyl)-4-ethyl-1,2-oxazol-5-amine
CID 107122508
3-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)-4-ethyl-1,2-oxazol-5-amine
CID 81261470
1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]-2,2-dimethylpropan-1-amine
CID 104672137
5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazole-3-carboxylic acid
CID 104672245

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine?
The IUPAC name of 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine (CID 113439304) is 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine is CCc1nnc(C)cc1-c1noc(N)c1CC.
What is the InChIKey of 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine?
The InChIKey is ZOPUNEQWYDGZMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-4-8-11(16-17-12(8)13)9-6-7(3)14-15-10(9)5-2/h6H,4-5,13H2,1-3H3.
What are the key properties of 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine?
4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine has a molecular weight of 232.29 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-(3-ethyl-6-methylpyridazin-4-yl)-1,2-oxazol-5-amine is sourced from PubChem (CID 113439304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).