4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide

C16H14N2O3S — CID 56783700

IUPAC4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide
SMILESCNC(=O)c1ccc(OCc2csc(-c3ccoc3)n2)cc1
InChIInChI=1S/C16H14N2O3S/c1-17-15(19)11-2-4-14(5-3-11)21-9-13-10-22-16(18-13)12-6-7-20-8-12/h2-8,10H,9H2,1H3,(H,17,19)
InChIKeyDLZBTTNCYIEZET-UHFFFAOYSA-N
MW314.37 g/mol
LogP3.34
Rot. Bonds5

About 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide

4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide (PubChem CID 56783700) has the molecular formula C16H14N2O3S and a molecular weight of 314.37 g/mol. Its IUPAC name is 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide.

Molecular Properties

Compound Name4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide
PubChem CID56783700
Molecular FormulaC16H14N2O3S
Molecular Weight314.37 g/mol
Exact Mass314.07
IUPAC Name4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide
SMILESCNC(=O)c1ccc(OCc2csc(-c3ccoc3)n2)cc1
InChIInChI=1S/C16H14N2O3S/c1-17-15(19)11-2-4-14(5-3-11)21-9-13-10-22-16(18-13)12-6-7-20-8-12/h2-8,10H,9H2,1H3,(H,17,19)
InChIKeyDLZBTTNCYIEZET-UHFFFAOYSA-N
XLogP3.34
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-4-[[2-(phenoxymethyl)-1,3-thiazol-4-yl]methoxy]benzamide
CID 51124164
2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-[2-(methylamino)ethyl]acetamide
CID 119502086
N-methyl-4-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoyl]amino]benzamide
CID 9158663
methyl 4-[[2-(4-carbamoylphenyl)-1,3-thiazol-4-yl]methoxy]benzoate
CID 60564920
2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-[2-(methylamino)propyl]acetamide;dihydrochloride
CID 120829889
N-[2-(ethylamino)ethyl]-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]acetamide
CID 119506982
3-[[2-[2-(furan-3-yl)-1,3-thiazol-4-yl]acetyl]amino]-2,2-dimethylpropanoic acid
CID 119249390
4-(2,2-dimethylpropyl)-2-(furan-3-yl)-1,3-thiazole
CID 166559603
2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxy-2,3-dimethylbutyl)acetamide
CID 111484065
2-[4-[(2-phenyl-1,3-thiazol-4-yl)methoxy]phenyl]acetic acid
CID 86776513
methyl 4-[[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methoxy]benzoate
CID 51173434
4-[4-[(4-nitrophenoxy)methyl]-1,3-thiazol-2-yl]benzamide
CID 60564841

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide?
The IUPAC name of 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide (CID 56783700) is 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide.
What is the SMILES notation for 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide?
The canonical SMILES for 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide is CNC(=O)c1ccc(OCc2csc(-c3ccoc3)n2)cc1.
What is the InChIKey of 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide?
The InChIKey is DLZBTTNCYIEZET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S/c1-17-15(19)11-2-4-14(5-3-11)21-9-13-10-22-16(18-13)12-6-7-20-8-12/h2-8,10H,9H2,1H3,(H,17,19).
What are the key properties of 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide?
4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide has a molecular weight of 314.37 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methoxy]-N-methylbenzamide is sourced from PubChem (CID 56783700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).