5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole

C13H19N3O — CID 146521558

IUPAC5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole
SMILESCC(C)c1cc(CC(C)c2ccno2)nn1C
InChIInChI=1S/C13H19N3O/c1-9(2)12-8-11(15-16(12)4)7-10(3)13-5-6-14-17-13/h5-6,8-10H,7H2,1-4H3
InChIKeyIUGAFSDTVXLVIR-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.88
Rot. Bonds4

About 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole

5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole (PubChem CID 146521558) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole.

Molecular Properties

Compound Name5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole
PubChem CID146521558
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole
SMILESCC(C)c1cc(CC(C)c2ccno2)nn1C
InChIInChI=1S/C13H19N3O/c1-9(2)12-8-11(15-16(12)4)7-10(3)13-5-6-14-17-13/h5-6,8-10H,7H2,1-4H3
InChIKeyIUGAFSDTVXLVIR-UHFFFAOYSA-N
XLogP2.88
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-amine
CID 105449516
N,N-dimethyl-1-(1-methyl-5-propan-2-ylpyrazol-3-yl)methanamine
CID 176992334
3-(1-methyl-5-propan-2-ylpyrazol-3-yl)propanoic acid
CID 82606665
3-chloro-1-methyl-5-propan-2-ylpyrazole
CID 58448762
5-(1,5-dimethylpyrazol-3-yl)-1,2-oxazole
CID 139378769
5-tert-butyl-1-methyl-3-(2-methylpropyl)pyrazole
CID 167374623
5-(1-prop-2-ynoxypropan-2-yl)-1,2-oxazole
CID 173185286
1-(3-ethyl-1-methylpyrazol-5-yl)-2-methylpropan-1-ol
CID 105133596
(3-ethyl-1-methylpyrazol-5-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107331991
2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide
CID 71934871
1-(3-ethyl-1-methylpyrazol-5-yl)-2-(furan-3-yl)ethanol
CID 105123108
2-(2,4-difluorophenyl)-1-(3-ethyl-1-methylpyrazol-5-yl)-N-methylethanamine
CID 105117177

Frequently Asked Questions

What is the IUPAC name of 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole?
The IUPAC name of 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole (CID 146521558) is 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole.
What is the SMILES notation for 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole?
The canonical SMILES for 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole is CC(C)c1cc(CC(C)c2ccno2)nn1C.
What is the InChIKey of 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole?
The InChIKey is IUGAFSDTVXLVIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9(2)12-8-11(15-16(12)4)7-10(3)13-5-6-14-17-13/h5-6,8-10H,7H2,1-4H3.
What are the key properties of 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole?
5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole has a molecular weight of 233.31 g/mol, XLogP of 2.88, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(1-methyl-5-propan-2-ylpyrazol-3-yl)propan-2-yl]-1,2-oxazole is sourced from PubChem (CID 146521558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).