N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide

C15H17N3O2S — CID 108529959

IUPACN-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide
SMILESCc1ccc(C)c(NC(=O)C(=O)Nc2nc(C)c(C)s2)c1
InChIInChI=1S/C15H17N3O2S/c1-8-5-6-9(2)12(7-8)17-13(19)14(20)18-15-16-10(3)11(4)21-15/h5-7H,1-4H3,(H,17,19)(H,16,18,20)
InChIKeyHHNHPUPNEYJUJT-UHFFFAOYSA-N
MW303.39 g/mol
LogP2.95
Rot. Bonds2

About N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide

N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide (PubChem CID 108529959) has the molecular formula C15H17N3O2S and a molecular weight of 303.39 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide
PubChem CID108529959
Molecular FormulaC15H17N3O2S
Molecular Weight303.39 g/mol
Exact Mass303.10
IUPAC NameN-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide
SMILESCc1ccc(C)c(NC(=O)C(=O)Nc2nc(C)c(C)s2)c1
InChIInChI=1S/C15H17N3O2S/c1-8-5-6-9(2)12(7-8)17-13(19)14(20)18-15-16-10(3)11(4)21-15/h5-7H,1-4H3,(H,17,19)(H,16,18,20)
InChIKeyHHNHPUPNEYJUJT-UHFFFAOYSA-N
XLogP2.95
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide
CID 108529987
N-(2,5-dimethylphenyl)-3-(4,5-dimethyl-1,3-thiazol-2-yl)propanamide
CID 110388753
3-[cyclopropyl-[2-(2,5-dimethylanilino)-2-oxoethyl]amino]-N-(4,5-dimethyl-1,3-thiazol-2-yl)propanamide
CID 84564566
N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide
CID 44995959
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-fluoro-4-methylbenzamide
CID 79769818
N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethyl-6-methylphenyl)oxamide
CID 108512119
N'-(2,5-dimethylphenyl)-N-(2-hydroxyphenyl)oxamide
CID 108514348
N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-methoxy-4-nitrophenyl)oxamide
CID 108513016
2-(2,5-dimethylanilino)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 1132750
N-(2,4-dimethylphenyl)-2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-4,6-dimethylpyrimidine-5-carboxamide
CID 16584145
N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(3-methoxyphenyl)oxamide
CID 108519615
4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4,5-dimethyl-1,3-thiazol-2-yl)benzamide
CID 18292040

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide?
The IUPAC name of N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide (CID 108529959) is N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide is Cc1ccc(C)c(NC(=O)C(=O)Nc2nc(C)c(C)s2)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide?
The InChIKey is HHNHPUPNEYJUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2S/c1-8-5-6-9(2)12(7-8)17-13(19)14(20)18-15-16-10(3)11(4)21-15/h5-7H,1-4H3,(H,17,19)(H,16,18,20).
What are the key properties of N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide?
N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide has a molecular weight of 303.39 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide is sourced from PubChem (CID 108529959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).