ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole

C13H17NO2 — CID 143041662

IUPACethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole
SMILESCC.COc1cc(C)ccc1-c1cnco1
InChIInChI=1S/C11H11NO2.C2H6/c1-8-3-4-9(10(5-8)13-2)11-6-12-7-14-11;1-2/h3-7H,1-2H3;1-2H3
InChIKeyRAXLSFUPWRDJCO-UHFFFAOYSA-N
MW219.28 g/mol
LogP3.68
Rot. Bonds2

About ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole

ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole (PubChem CID 143041662) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole.

Molecular Properties

Compound Nameethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole
PubChem CID143041662
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Nameethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole
SMILESCC.COc1cc(C)ccc1-c1cnco1
InChIInChI=1S/C11H11NO2.C2H6/c1-8-3-4-9(10(5-8)13-2)11-6-12-7-14-11;1-2/h3-7H,1-2H3;1-2H3
InChIKeyRAXLSFUPWRDJCO-UHFFFAOYSA-N
XLogP3.68
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;5-(2-methoxy-4-methylphenyl)-1,3-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

5-methyl-2-(1,3-oxazol-5-yl)phenol
CID 123933373
3-methoxy-4-(1,3-oxazol-5-yl)benzoic acid
CID 23577995
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-5-methyl-1,3-benzoxazol-2-amine
CID 23563141
1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-[(4-methylphenyl)methyl]urea
CID 12051287
5-(2,4-dimethoxy-5-propan-2-ylphenyl)-1,3-oxazole
CID 68972183
3-methoxy-N-[(5-methylfuran-2-yl)methyl]-4-(1,3-oxazol-5-yl)aniline
CID 71736990
N'-[4-(2-acetamido-5-methylphenoxy)-2-methylbutan-2-yl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]oxamide
CID 20766766
ethyl 2-amino-2-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-oxopropanoate
CID 57212468
N'-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-N-phenylpropanediamide
CID 10338010
N-[5-methoxy-2-methyl-4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 123287218
3-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-5-(2-methoxyphenyl)-4-methyl-2H-1,3-oxazol-2-amine
CID 67046578
(2R,6S)-4-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
CID 142165611

Frequently Asked Questions

What is the IUPAC name of ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole?
The IUPAC name of ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole (CID 143041662) is ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole.
What is the SMILES notation for ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole?
The canonical SMILES for ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole is CC.COc1cc(C)ccc1-c1cnco1.
What is the InChIKey of ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole?
The InChIKey is RAXLSFUPWRDJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2.C2H6/c1-8-3-4-9(10(5-8)13-2)11-6-12-7-14-11;1-2/h3-7H,1-2H3;1-2H3.
What are the key properties of ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole?
ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole has a molecular weight of 219.28 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole is sourced from PubChem (CID 143041662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).