N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide

C14H16N2O3S — CID 903456

IUPACN-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)c(C)s2)c(OC)c1
InChIInChI=1S/C14H16N2O3S/c1-8-9(2)20-14(15-8)16-13(17)11-6-5-10(18-3)7-12(11)19-4/h5-7H,1-4H3,(H,15,16,17)
InChIKeyIXUKSJCLEQSSES-UHFFFAOYSA-N
MW292.36 g/mol
LogP3.03
Rot. Bonds4

About N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide (PubChem CID 903456) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide
PubChem CID903456
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)c(C)s2)c(OC)c1
InChIInChI=1S/C14H16N2O3S/c1-8-9(2)20-14(15-8)16-13(17)11-6-5-10(18-3)7-12(11)19-4/h5-7H,1-4H3,(H,15,16,17)
InChIKeyIXUKSJCLEQSSES-UHFFFAOYSA-N
XLogP3.03
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxy-3-methylbenzamide
CID 110763421
N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-2,4-dimethoxy-N-(2-methoxyethyl)benzamide
CID 3426870
N-(4-fluoro-1,3-benzothiazol-2-yl)-2,4-dimethoxybenzamide
CID 7193198
N-(4-chloro-1,3-benzothiazol-2-yl)-2,4-dimethoxybenzamide
CID 2037986
N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,4-dimethoxybenzamide
CID 1091092
N-(5-bromo-6-methyl-2-pyridinyl)-2,4-dimethoxybenzamide
CID 17274555
N-[4-(chloromethyl)-1,3-thiazol-2-yl]-2,4-dimethoxybenzamide
CID 43140311
N-[5-(methanesulfonamido)-1,3,4-thiadiazol-2-yl]-2,4-dimethoxybenzamide
CID 55979400
N-acenaphthyleno[1,2-d][1,3]thiazol-8-yl-2,4-dimethoxybenzamide
CID 3600880
2,4-dimethoxy-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)benzamide
CID 17177149
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2,4-dimethoxybenzamide
CID 18075073
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(4-methoxyphenyl)acetamide
CID 8797725

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide?
The IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide (CID 903456) is N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2nc(C)c(C)s2)c(OC)c1.
What is the InChIKey of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide?
The InChIKey is IXUKSJCLEQSSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-8-9(2)20-14(15-8)16-13(17)11-6-5-10(18-3)7-12(11)19-4/h5-7H,1-4H3,(H,15,16,17).
What are the key properties of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide?
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide has a molecular weight of 292.36 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2,4-dimethoxybenzamide is sourced from PubChem (CID 903456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).