2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide

C14H16N2O3S — CID 17414170

IUPAC2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide
SMILESCCOc1ccc(OCC)c(C(=O)Nc2nccs2)c1
InChIInChI=1S/C14H16N2O3S/c1-3-18-10-5-6-12(19-4-2)11(9-10)13(17)16-14-15-7-8-20-14/h5-9H,3-4H2,1-2H3,(H,15,16,17)
InChIKeyFZRZJLIZCKJJIK-UHFFFAOYSA-N
MW292.36 g/mol
LogP3.19
Rot. Bonds6

About 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide

2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 17414170) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide
PubChem CID17414170
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide
SMILESCCOc1ccc(OCC)c(C(=O)Nc2nccs2)c1
InChIInChI=1S/C14H16N2O3S/c1-3-18-10-5-6-12(19-4-2)11(9-10)13(17)16-14-15-7-8-20-14/h5-9H,3-4H2,1-2H3,(H,15,16,17)
InChIKeyFZRZJLIZCKJJIK-UHFFFAOYSA-N
XLogP3.19
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide (CID 17414170) is 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide is CCOc1ccc(OCC)c(C(=O)Nc2nccs2)c1.
What is the InChIKey of 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is FZRZJLIZCKJJIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-3-18-10-5-6-12(19-4-2)11(9-10)13(17)16-14-15-7-8-20-14/h5-9H,3-4H2,1-2H3,(H,15,16,17).
What are the key properties of 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide?
2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 292.36 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethoxy-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 17414170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).