5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole

C13H13N3O — CID 25164677

IUPAC5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole
SMILESCCCc1cc(-c2ccc3[nH]ncc3c2)on1
InChIInChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
InChIKeyOHLKBSAOSZPTFS-UHFFFAOYSA-N
MW227.27 g/mol
LogP3.17
Rot. Bonds3

About 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole

5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole (PubChem CID 25164677) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole.

Molecular Properties

Compound Name5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole
PubChem CID25164677
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole
SMILESCCCc1cc(-c2ccc3[nH]ncc3c2)on1
InChIInChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15)
InChIKeyOHLKBSAOSZPTFS-UHFFFAOYSA-N
XLogP3.17
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(1H-indazol-5-yl)-3-propyl-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

3-phenyl-5-(1H-pyrazol-3-yl)isoxazole
CID 24764436
5-methyl-3-phenyl-4-(1H-pyrazol-5-yl)isoxazole
CID 2745568
3-(4-fluorophenyl)-5-(1H-pyrazol-5-yl)-2,1-benzoxazole
CID 1474300
5-(1h-Indazol-5-yl)-n-methylisoxazole-3-carboxamide
CID 25164674
3-benzyl-5-(1H-indazol-5-yl)isoxazole
CID 25164675
5-(1H-indazol-5-yl)-3-(piperidin-1-ylmethyl)isoxazole
CID 25165081
5-(3-Benzylisoxazol-5-yl)-1h-indazol-3-amine
CID 25165278
3-(4-chlorophenyl)-5-methyl-4-(1H-pyrazol-5-yl)isoxazole
CID 2745567
[5-(1H-indazol-5-yl)-1,2-oxazol-3-yl]-piperidin-1-ylmethanone
CID 25164885
[5-(1H-indazol-5-yl)-1,2-oxazol-3-yl]methanol
CID 25165082
5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine
CID 25165277
1-[5-(1H-indazol-5-yl)-1,2-oxazole-3-carbonyl]piperidine-3-carboxamide
CID 49830477

Frequently Asked Questions

What is the IUPAC name of 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole?
The IUPAC name of 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole (CID 25164677) is 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole.
What is the SMILES notation for 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole?
The canonical SMILES for 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole is CCCc1cc(-c2ccc3[nH]ncc3c2)on1.
What is the InChIKey of 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole?
The InChIKey is OHLKBSAOSZPTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-2-3-11-7-13(17-16-11)9-4-5-12-10(6-9)8-14-15-12/h4-8H,2-3H2,1H3,(H,14,15).
What are the key properties of 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole?
5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole has a molecular weight of 227.27 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indazol-5-yl)-3-propyl-1,2-oxazole is sourced from PubChem (CID 25164677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).