4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole

C15H15N3O2 — CID 71984752

IUPAC4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole
SMILESCc1noc(C)c1COc1cccc(-n2ccnc2)c1
InChIInChI=1S/C15H15N3O2/c1-11-15(12(2)20-17-11)9-19-14-5-3-4-13(8-14)18-7-6-16-10-18/h3-8,10H,9H2,1-2H3
InChIKeySDFWQOPEDAOWQO-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.06
Rot. Bonds4

About 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole

4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole (PubChem CID 71984752) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole.

Molecular Properties

Compound Name4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole
PubChem CID71984752
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole
SMILESCc1noc(C)c1COc1cccc(-n2ccnc2)c1
InChIInChI=1S/C15H15N3O2/c1-11-15(12(2)20-17-11)9-19-14-5-3-4-13(8-14)18-7-6-16-10-18/h3-8,10H,9H2,1-2H3
InChIKeySDFWQOPEDAOWQO-UHFFFAOYSA-N
XLogP3.06
TPSA53.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-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

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(4-imidazol-1-ylphenyl)benzamide
CID 37182358
1-[3-(3-methylsulfonylpropoxy)phenyl]imidazole
CID 71984751
(Z)-3-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]prop-2-enoic acid
CID 97301415
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-imidazol-1-ylaniline
CID 43673562
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 9209133
[3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-(4-methylpiperazin-1-yl)methanone
CID 7964223
7-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]naphthalen-2-ol
CID 43326466
cyanomethyl 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate
CID 2637058
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide
CID 51188159
6-(3-ethoxyphenyl)-4-imidazol-1-ylpyran-2-one
CID 142677422
4-[(2-fluoro-3-methylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole
CID 103988426
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[4-(6-imidazol-1-ylpyrimidin-4-yl)oxyphenyl]acetamide
CID 122312071

Frequently Asked Questions

What is the IUPAC name of 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole?
The IUPAC name of 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole (CID 71984752) is 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole.
What is the SMILES notation for 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole?
The canonical SMILES for 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole is Cc1noc(C)c1COc1cccc(-n2ccnc2)c1.
What is the InChIKey of 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole?
The InChIKey is SDFWQOPEDAOWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-11-15(12(2)20-17-11)9-19-14-5-3-4-13(8-14)18-7-6-16-10-18/h3-8,10H,9H2,1-2H3.
What are the key properties of 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole?
4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole has a molecular weight of 269.30 g/mol, XLogP of 3.06, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-imidazol-1-ylphenoxy)methyl]-3,5-dimethyl-1,2-oxazole is sourced from PubChem (CID 71984752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).