N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide

C12H11N3O3S — CID 44997307

IUPACN-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
SMILESCc1csc(NC(=O)C(=O)Nc2cccc(O)c2)n1
InChIInChI=1S/C12H11N3O3S/c1-7-6-19-12(13-7)15-11(18)10(17)14-8-3-2-4-9(16)5-8/h2-6,16H,1H3,(H,14,17)(H,13,15,18)
InChIKeyZKYHKHGYNOSING-UHFFFAOYSA-N
MW277.31 g/mol
LogP1.73
Rot. Bonds2

About N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide

N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide (PubChem CID 44997307) has the molecular formula C12H11N3O3S and a molecular weight of 277.31 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
PubChem CID44997307
Molecular FormulaC12H11N3O3S
Molecular Weight277.31 g/mol
Exact Mass277.05
IUPAC NameN-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
SMILESCc1csc(NC(=O)C(=O)Nc2cccc(O)c2)n1
InChIInChI=1S/C12H11N3O3S/c1-7-6-19-12(13-7)15-11(18)10(17)14-8-3-2-4-9(16)5-8/h2-6,16H,1H3,(H,14,17)(H,13,15,18)
InChIKeyZKYHKHGYNOSING-UHFFFAOYSA-N
XLogP1.73
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.31
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(6-methyl-2-pyridinyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
CID 108519296
N-(3-hydroxyphenyl)-N'-(3-methylphenyl)oxamide
CID 10445826
2-(3-hydroxyphenyl)sulfanyl-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 104590763
N-(1H-indazol-6-yl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
CID 108519338
2-N,6-N-bis(4-methyl-1,3-thiazol-2-yl)pyridine-2,6-dicarboxamide
CID 19684989
N-(4-methyl-1,3-thiazol-2-yl)-N'-(1-phenylethyl)oxamide
CID 44997308
N-(2,5-difluorophenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
CID 108519396
N'-(3-hydroxyphenyl)-N-(2-methylpropyl)oxamide
CID 45000278
2-[3-[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]phenoxy]acetic acid
CID 61196286
N-(3-hydroxyphenyl)-N'-(2,3,5,6-tetrachlorophenyl)oxamide
CID 10250012
N'-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)oxamide
CID 45000850
2-hydroxy-4-[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]benzoic acid
CID 61195157

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide?
The IUPAC name of N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide (CID 44997307) is N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide?
The canonical SMILES for N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide is Cc1csc(NC(=O)C(=O)Nc2cccc(O)c2)n1.
What is the InChIKey of N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide?
The InChIKey is ZKYHKHGYNOSING-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O3S/c1-7-6-19-12(13-7)15-11(18)10(17)14-8-3-2-4-9(16)5-8/h2-6,16H,1H3,(H,14,17)(H,13,15,18).
What are the key properties of N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide?
N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide has a molecular weight of 277.31 g/mol, XLogP of 1.73, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide is sourced from PubChem (CID 44997307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).