2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide

C15H16N2O3S — CID 2095287

IUPAC2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide
SMILESCC1(C)Cc2cccc(OCC(=O)Nc3nccs3)c2O1
InChIInChI=1S/C15H16N2O3S/c1-15(2)8-10-4-3-5-11(13(10)20-15)19-9-12(18)17-14-16-6-7-21-14/h3-7H,8-9H2,1-2H3,(H,16,17,18)
InChIKeyCIGQGDFNXCKNEB-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.87
Rot. Bonds4

About 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide

2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 2095287) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide
PubChem CID2095287
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide
SMILESCC1(C)Cc2cccc(OCC(=O)Nc3nccs3)c2O1
InChIInChI=1S/C15H16N2O3S/c1-15(2)8-10-4-3-5-11(13(10)20-15)19-9-12(18)17-14-16-6-7-21-14/h3-7H,8-9H2,1-2H3,(H,16,17,18)
InChIKeyCIGQGDFNXCKNEB-UHFFFAOYSA-N
XLogP2.87
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,3-dimethylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 888214
8-methoxy-N-(1,3-thiazol-2-yl)-2H-chromene-3-carboxamide
CID 1478778
4-(2,3-dimethylphenoxy)-N-1,3-thiazol-2-ylbutanamide
CID 1575135
2-(2,5-dimethylphenoxy)-N-(1,3-thiazol-2-yl)propanamide
CID 4944777
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 2102526
2-(4,7-dimethyl-2-oxochromen-5-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
CID 8069390
2-(3-methylphenoxy)-N-(1,3-thiazol-2-yl)propanamide
CID 2977276
4-(2,5-Dimethyl-phenoxy)-N-thiazol-2-yl-butyramide
CID 1570488
N-(thiazol-2-yl)-2-((3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy)acetamide
CID 8070844
2-(4-ethylphenoxy)-N-(1,3-thiazol-2-yl)propanamide
CID 4953314
[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl] (E)-3-[3-(methoxymethoxy)-4-phenylmethoxyphenyl]prop-2-enoate
CID 49865500
2-(2-methylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 677118

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide (CID 2095287) is 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide is CC1(C)Cc2cccc(OCC(=O)Nc3nccs3)c2O1.
What is the InChIKey of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is CIGQGDFNXCKNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-15(2)8-10-4-3-5-11(13(10)20-15)19-9-12(18)17-14-16-6-7-21-14/h3-7H,8-9H2,1-2H3,(H,16,17,18).
What are the key properties of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide?
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 304.37 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 2095287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).