3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide

C14H16N2O3S — CID 2083346

IUPAC3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide
SMILESCCCOc1ccc(C(=O)Nc2nccs2)cc1OC
InChIInChI=1S/C14H16N2O3S/c1-3-7-19-11-5-4-10(9-12(11)18-2)13(17)16-14-15-6-8-20-14/h4-6,8-9H,3,7H2,1-2H3,(H,15,16,17)
InChIKeyGVMXELQLKZQBGW-UHFFFAOYSA-N
MW292.36 g/mol
LogP3.19
Rot. Bonds6

About 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide

3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 2083346) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide
PubChem CID2083346
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide
SMILESCCCOc1ccc(C(=O)Nc2nccs2)cc1OC
InChIInChI=1S/C14H16N2O3S/c1-3-7-19-11-5-4-10(9-12(11)18-2)13(17)16-14-15-6-8-20-14/h4-6,8-9H,3,7H2,1-2H3,(H,15,16,17)
InChIKeyGVMXELQLKZQBGW-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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Related Compounds

4-butoxy-3-methoxy-N-(1,3-thiazol-2-yl)benzamide
CID 2666591
3-bromo-4-(2-methoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 15943256
3-bromo-5-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide
CID 4797157
3-ethoxy-4-(2-phenoxyethoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 2472295
3-propoxy-N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 17361447
3-(3-aminoprop-1-ynyl)-4-methoxy-N-(1,3-thiazol-2-yl)benzamide
CID 61033326
4-butoxy-N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
CID 31038115
N-(3,5-dimethylphenyl)-3-methoxy-4-propoxybenzamide
CID 2683270
4-hexoxy-3-methoxy-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide
CID 55360863
3,4-dimethoxy-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide
CID 811235
4-[(2-cyclopentylacetyl)amino]-3-methoxy-N-(1,3-thiazol-2-yl)benzamide
CID 11222117
2-(3,4-dimethoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 648788

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide (CID 2083346) is 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide is CCCOc1ccc(C(=O)Nc2nccs2)cc1OC.
What is the InChIKey of 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is GVMXELQLKZQBGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-3-7-19-11-5-4-10(9-12(11)18-2)13(17)16-14-15-6-8-20-14/h4-6,8-9H,3,7H2,1-2H3,(H,15,16,17).
What are the key properties of 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide?
3-methoxy-4-propoxy-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 3-methoxy-4-propoxy-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2083346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).