3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide

C20H21N3O3 — CID 67706985

IUPAC3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide
SMILESNNC(=O)CCc1ccc(OCCc2coc(-c3ccccc3)n2)cc1
InChIInChI=1S/C20H21N3O3/c21-23-19(24)11-8-15-6-9-18(10-7-15)25-13-12-17-14-26-20(22-17)16-4-2-1-3-5-16/h1-7,9-10,14H,8,11-13,21H2,(H,23,24)
InChIKeyMAWHIXZWUPNOEX-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.89
Rot. Bonds8

About 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide

3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide (PubChem CID 67706985) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide.

Molecular Properties

Compound Name3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide
PubChem CID67706985
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide
SMILESNNC(=O)CCc1ccc(OCCc2coc(-c3ccccc3)n2)cc1
InChIInChI=1S/C20H21N3O3/c21-23-19(24)11-8-15-6-9-18(10-7-15)25-13-12-17-14-26-20(22-17)16-4-2-1-3-5-16/h1-7,9-10,14H,8,11-13,21H2,(H,23,24)
InChIKeyMAWHIXZWUPNOEX-UHFFFAOYSA-N
XLogP2.89
TPSA90.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide 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

(2-phenyl-1,3-oxazol-4-yl)methyl 3-(4-methoxyphenyl)propanoate
CID 31718301
[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl methanimidothioate
CID 142046622
2-methylsulfonyl-1-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]ethanone
CID 59093125
2-[acetyl-[[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]-2-phenylacetic acid
CID 142216313
N-methyl-2-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]sulfanylacetohydrazide
CID 67706926
2-[(2-benzoylphenyl)methyl]-3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanoic acid
CID 143294203
3-(4-chlorophenoxy)propyl 2-(2-phenyl-1,3-oxazol-4-yl)acetate
CID 55568894
4-[2-[3-(bromomethyl)phenoxy]ethyl]-2-phenyl-1,3-oxazole
CID 18617241
N-(4-ethoxyphenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34802338
3-phenyl-N-[4-(2-phenylethoxy)phenyl]propanamide
CID 17066904
(2-phenyl-1,3-oxazol-4-yl)methyl 3-[(2-phenylacetyl)amino]propanoate
CID 55508930
1-[[4-(2-methoxyethoxy)phenyl]methyl]-2-methyl-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine;hydroiodide
CID 111551841

Frequently Asked Questions

What is the IUPAC name of 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide?
The IUPAC name of 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide (CID 67706985) is 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide.
What is the SMILES notation for 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide?
The canonical SMILES for 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide is NNC(=O)CCc1ccc(OCCc2coc(-c3ccccc3)n2)cc1.
What is the InChIKey of 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide?
The InChIKey is MAWHIXZWUPNOEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c21-23-19(24)11-8-15-6-9-18(10-7-15)25-13-12-17-14-26-20(22-17)16-4-2-1-3-5-16/h1-7,9-10,14H,8,11-13,21H2,(H,23,24).
What are the key properties of 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide?
3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide has a molecular weight of 351.41 g/mol, XLogP of 2.89, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanehydrazide is sourced from PubChem (CID 67706985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).