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

C11H9IN2O2S — CID 37018478

IUPAC2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cc(I)ccc2O)n1
InChIInChI=1S/C11H9IN2O2S/c1-6-5-17-11(13-6)14-10(16)8-4-7(12)2-3-9(8)15/h2-5,15H,1H3,(H,13,14,16)
InChIKeyFYBYCCWMLOYEGF-UHFFFAOYSA-N
MW360.18 g/mol
LogP3.01
Rot. Bonds2

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

2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 37018478) has the molecular formula C11H9IN2O2S and a molecular weight of 360.18 g/mol. Its IUPAC name is 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID37018478
Molecular FormulaC11H9IN2O2S
Molecular Weight360.18 g/mol
Exact Mass359.94
IUPAC Name2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cc(I)ccc2O)n1
InChIInChI=1S/C11H9IN2O2S/c1-6-5-17-11(13-6)14-10(16)8-4-7(12)2-3-9(8)15/h2-5,15H,1H3,(H,13,14,16)
InChIKeyFYBYCCWMLOYEGF-UHFFFAOYSA-N
XLogP3.01
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.18
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 885062
3-hydroxy-4-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 104627766
2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 884818
2-hydroxy-5-iodo-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
CID 103602080
N-(4-chloro-1,3-thiazol-2-yl)-2-hydroxy-5-methylbenzamide
CID 102523467
2,4-diamino-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 61089683
2-hydroxy-5-iodo-N-(4-iodo-2-methylphenyl)benzamide
CID 86251688
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-hydroxy-5-methylbenzamide
CID 60654609
3-[(2-hydroxy-5-iodobenzoyl)amino]-4-methylthiophene-2-carboxylic acid
CID 107731465
5-(hydroperoxyamino)-2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 59104321
5-[(3-fluorophenyl)methoxy]-2-hydroxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 141216458
2,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)-1H-pyrrole-3-carboxamide
CID 110766253

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 37018478) is 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide is Cc1csc(NC(=O)c2cc(I)ccc2O)n1.
What is the InChIKey of 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is FYBYCCWMLOYEGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9IN2O2S/c1-6-5-17-11(13-6)14-10(16)8-4-7(12)2-3-9(8)15/h2-5,15H,1H3,(H,13,14,16).
What are the key properties of 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 360.18 g/mol, XLogP of 3.01, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 37018478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).