4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole

C12H13NOS — CID 116967726

IUPAC4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole
SMILESCOc1nc(-c2ccc(C)cc2C)cs1
InChIInChI=1S/C12H13NOS/c1-8-4-5-10(9(2)6-8)11-7-15-12(13-11)14-3/h4-7H,1-3H3
InChIKeyHZIVMGISJHTEKO-UHFFFAOYSA-N
MW219.31 g/mol
LogP3.44
Rot. Bonds2

About 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole

4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole (PubChem CID 116967726) has the molecular formula C12H13NOS and a molecular weight of 219.31 g/mol. Its IUPAC name is 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole.

Molecular Properties

Compound Name4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole
PubChem CID116967726
Molecular FormulaC12H13NOS
Molecular Weight219.31 g/mol
Exact Mass219.07
IUPAC Name4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole
SMILESCOc1nc(-c2ccc(C)cc2C)cs1
InChIInChI=1S/C12H13NOS/c1-8-4-5-10(9(2)6-8)11-7-15-12(13-11)14-3/h4-7H,1-3H3
InChIKeyHZIVMGISJHTEKO-UHFFFAOYSA-N
XLogP3.44
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4-dimethylphenyl)-2-(methoxymethyl)-1,3-thiazole
CID 116969941
ethane;2-methoxy-4-(4-methylphenyl)-1,3-thiazole
CID 145078481
4-(2,4-dimethylphenyl)-N-methyl-1,3-thiazol-2-amine
CID 17465165
4-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 8962177
1-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-methylpropan-2-amine
CID 116964953
4-(2,4-dimethylphenyl)-2-methoxy-6-methylpyrimidine
CID 116896809
[1-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]cyclopropyl]methanol
CID 116966908
4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 55027261
4-N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]benzene-1,4-diamine
CID 82059186
4-(2,4-dimethylphenyl)-N-prop-2-enyl-1,3-thiazol-2-amine
CID 2059129
3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-methylpropan-1-amine
CID 116965093
3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]butan-1-ol
CID 82121806

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole?
The IUPAC name of 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole (CID 116967726) is 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole.
What is the SMILES notation for 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole?
The canonical SMILES for 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole is COc1nc(-c2ccc(C)cc2C)cs1.
What is the InChIKey of 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole?
The InChIKey is HZIVMGISJHTEKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NOS/c1-8-4-5-10(9(2)6-8)11-7-15-12(13-11)14-3/h4-7H,1-3H3.
What are the key properties of 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole?
4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole has a molecular weight of 219.31 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole is sourced from PubChem (CID 116967726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).