3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide

C13H14N2O3S — CID 2109069

IUPAC3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ncc(C)s2)cc1OC
InChIInChI=1S/C13H14N2O3S/c1-8-7-14-13(19-8)15-12(16)9-4-5-10(17-2)11(6-9)18-3/h4-7H,1-3H3,(H,14,15,16)
InChIKeyPQGIEIZYRGMWMM-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.72
Rot. Bonds4

About 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide

3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 2109069) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID2109069
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC Name3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ncc(C)s2)cc1OC
InChIInChI=1S/C13H14N2O3S/c1-8-7-14-13(19-8)15-12(16)9-4-5-10(17-2)11(6-9)18-3/h4-7H,1-3H3,(H,14,15,16)
InChIKeyPQGIEIZYRGMWMM-UHFFFAOYSA-N
XLogP2.72
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-4-[(2-methylphenyl)methoxy]-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 145489208
3,4-dimethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170799
3-(3-hydroxyprop-1-ynyl)-4-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 61033971
3-amino-4-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 61090016
5-amino-2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 61092626
4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63212388
2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 803477
4-methoxy-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]benzoic acid
CID 63744641
4-hydrazinyl-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63211746
4-bromo-3-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47421860
3,4-dimethoxy-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]benzamide
CID 110739313
N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3,4-dimethoxybenzamide
CID 1086871

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 2109069) is 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide is COc1ccc(C(=O)Nc2ncc(C)s2)cc1OC.
What is the InChIKey of 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is PQGIEIZYRGMWMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-8-7-14-13(19-8)15-12(16)9-4-5-10(17-2)11(6-9)18-3/h4-7H,1-3H3,(H,14,15,16).
What are the key properties of 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 278.33 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2109069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).