2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide

C19H18N2O2S — CID 8795737

IUPAC2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
SMILESCc1cc(C)cc(OCC(=O)Nc2ccc(-c3nccs3)cc2)c1
InChIInChI=1S/C19H18N2O2S/c1-13-9-14(2)11-17(10-13)23-12-18(22)21-16-5-3-15(4-6-16)19-20-7-8-24-19/h3-11H,12H2,1-2H3,(H,21,22)
InChIKeyIBKMJHOIBCZCFT-UHFFFAOYSA-N
MW338.43 g/mol
LogP4.44
Rot. Bonds5

About 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide

2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide (PubChem CID 8795737) has the molecular formula C19H18N2O2S and a molecular weight of 338.43 g/mol. Its IUPAC name is 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
PubChem CID8795737
Molecular FormulaC19H18N2O2S
Molecular Weight338.43 g/mol
Exact Mass338.11
IUPAC Name2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
SMILESCc1cc(C)cc(OCC(=O)Nc2ccc(-c3nccs3)cc2)c1
InChIInChI=1S/C19H18N2O2S/c1-13-9-14(2)11-17(10-13)23-12-18(22)21-16-5-3-15(4-6-16)19-20-7-8-24-19/h3-11H,12H2,1-2H3,(H,21,22)
InChIKeyIBKMJHOIBCZCFT-UHFFFAOYSA-N
XLogP4.44
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 17434847
2-[(2-methylpropan-2-yl)oxy]-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 115950100
2-[(2-phenoxyacetyl)amino]-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 27701577
N-(4-methylphenyl)-2-[2-oxo-2-[4-(1,3-thiazol-2-yl)anilino]ethyl]sulfanylacetamide
CID 27701903
2-(4-methoxyphenyl)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 8795536
2-(2-chlorophenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 8795729
2-(3,5-dimethylphenoxy)-N-(4-iodophenyl)acetamide
CID 2554425
3-methoxy-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
CID 51108495
2-(propan-2-ylamino)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 54862203
2,4,6-trimethyl-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
CID 84534803
N-[(3,5-dimethylphenyl)methyl]-4-(1,3-thiazol-2-yl)aniline
CID 60694542
2-(prop-2-ynylamino)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 79287112

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide?
The IUPAC name of 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide (CID 8795737) is 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide?
The canonical SMILES for 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide is Cc1cc(C)cc(OCC(=O)Nc2ccc(-c3nccs3)cc2)c1.
What is the InChIKey of 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide?
The InChIKey is IBKMJHOIBCZCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2S/c1-13-9-14(2)11-17(10-13)23-12-18(22)21-16-5-3-15(4-6-16)19-20-7-8-24-19/h3-11H,12H2,1-2H3,(H,21,22).
What are the key properties of 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide?
2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide has a molecular weight of 338.43 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenoxy)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide is sourced from PubChem (CID 8795737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).