3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide

C19H18N2O3S — CID 90626060

IUPAC3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2-c2csc(C)n2)cc1OC
InChIInChI=1S/C19H18N2O3S/c1-12-20-16(11-25-12)14-6-4-5-7-15(14)21-19(22)13-8-9-17(23-2)18(10-13)24-3/h4-11H,1-3H3,(H,21,22)
InChIKeyKUUJMODAYUKYLQ-UHFFFAOYSA-N
MW354.43 g/mol
LogP4.39
Rot. Bonds5

About 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide

3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide (PubChem CID 90626060) has the molecular formula C19H18N2O3S and a molecular weight of 354.43 g/mol. Its IUPAC name is 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
PubChem CID90626060
Molecular FormulaC19H18N2O3S
Molecular Weight354.43 g/mol
Exact Mass354.10
IUPAC Name3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2-c2csc(C)n2)cc1OC
InChIInChI=1S/C19H18N2O3S/c1-12-20-16(11-25-12)14-6-4-5-7-15(14)21-19(22)13-8-9-17(23-2)18(10-13)24-3/h4-11H,1-3H3,(H,21,22)
InChIKeyKUUJMODAYUKYLQ-UHFFFAOYSA-N
XLogP4.39
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dimethyl-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626115
2-(4-acetyl-2-methoxyphenoxy)-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 90626142
6-methoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]pyridazine-3-carboxamide
CID 90626314
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]pyridine-2-carboxamide
CID 90626104
dimethyl (E)-2-[2-(2-methyl-1,3-thiazol-4-yl)anilino]but-2-enedioate
CID 168569919
3,4-dimethoxy-N-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)phenyl]benzamide
CID 30330830
[2-(2-methyl-1,3-thiazol-4-yl)phenyl]thiourea
CID 169357373
2,5-dichloro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626071
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]propanamide
CID 90626039
2-(3,4-dimethylphenoxy)-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 90626166
1-(3-methoxyphenyl)-3-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]urea
CID 90626924
2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626068

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The IUPAC name of 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide (CID 90626060) is 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The canonical SMILES for 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide is COc1ccc(C(=O)Nc2ccccc2-c2csc(C)n2)cc1OC.
What is the InChIKey of 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The InChIKey is KUUJMODAYUKYLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3S/c1-12-20-16(11-25-12)14-6-4-5-7-15(14)21-19(22)13-8-9-17(23-2)18(10-13)24-3/h4-11H,1-3H3,(H,21,22).
What are the key properties of 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide has a molecular weight of 354.43 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 90626060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).