methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole

C12H15NO — CID 161177844

IUPACmethane;5-methyl-3-(3-methylphenyl)-1,2-oxazole
SMILESC.Cc1cccc(-c2cc(C)on2)c1
InChIInChI=1S/C11H11NO.CH4/c1-8-4-3-5-10(6-8)11-7-9(2)13-12-11;/h3-7H,1-2H3;1H4
InChIKeyUSAYJRVXZIKYIK-UHFFFAOYSA-N
MW189.26 g/mol
LogP3.59
Rot. Bonds1

About methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole

methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole (PubChem CID 161177844) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole.

Molecular Properties

Compound Namemethane;5-methyl-3-(3-methylphenyl)-1,2-oxazole
PubChem CID161177844
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Namemethane;5-methyl-3-(3-methylphenyl)-1,2-oxazole
SMILESC.Cc1cccc(-c2cc(C)on2)c1
InChIInChI=1S/C11H11NO.CH4/c1-8-4-3-5-10(6-8)11-7-9(2)13-12-11;/h3-7H,1-2H3;1H4
InChIKeyUSAYJRVXZIKYIK-UHFFFAOYSA-N
XLogP3.59
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze methane;5-methyl-3-(3-methylphenyl)-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

5-(1-chloroethyl)-3-(3-methylphenyl)-1,2-oxazole
CID 134528371
N-ethyl-3-(3-methylphenyl)-1,2-oxazol-5-amine
CID 19082396
5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole
CID 44546226
3-(3-methylphenyl)-5-phenyl-1,2,4-oxadiazole
CID 2239223
methane;1-methyl-3-(4-methylphenyl)benzene
CID 158328523
4-(3-bromophenyl)-2-(3-methylphenyl)-1,3-thiazole
CID 78913074
N-methyl-5-(3-methylphenyl)-1,2,4-oxadiazol-3-amine
CID 56924173
ethane;2-methyl-4-(3-methylphenyl)-1,3-thiazole
CID 142374611
4,6-bis(3-methylphenyl)pyrimidin-2-amine
CID 75360131
ethane;1-methyl-3-[3-[3-(3-methylphenyl)phenyl]phenyl]benzene
CID 90845848
CID 74539607
CID 74539607
5-(3-methylphenyl)-3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazole
CID 53035902

Frequently Asked Questions

What is the IUPAC name of methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole?
The IUPAC name of methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole (CID 161177844) is methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole.
What is the SMILES notation for methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole?
The canonical SMILES for methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole is C.Cc1cccc(-c2cc(C)on2)c1.
What is the InChIKey of methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole?
The InChIKey is USAYJRVXZIKYIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO.CH4/c1-8-4-3-5-10(6-8)11-7-9(2)13-12-11;/h3-7H,1-2H3;1H4.
What are the key properties of methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole?
methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole has a molecular weight of 189.26 g/mol, XLogP of 3.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole is sourced from PubChem (CID 161177844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).