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

C11H9IN2OS — CID 884818

IUPAC2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2ccccc2I)n1
InChIInChI=1S/C11H9IN2OS/c1-7-6-16-11(13-7)14-10(15)8-4-2-3-5-9(8)12/h2-6H,1H3,(H,13,14,15)
InChIKeyPANMRGCRBNVTKY-UHFFFAOYSA-N
MW344.18 g/mol
LogP3.31
Rot. Bonds2

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

2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 884818) has the molecular formula C11H9IN2OS and a molecular weight of 344.18 g/mol. Its IUPAC name is 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID884818
Molecular FormulaC11H9IN2OS
Molecular Weight344.18 g/mol
Exact Mass343.95
IUPAC Name2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2ccccc2I)n1
InChIInChI=1S/C11H9IN2OS/c1-7-6-16-11(13-7)14-10(15)8-4-2-3-5-9(8)12/h2-6H,1H3,(H,13,14,15)
InChIKeyPANMRGCRBNVTKY-UHFFFAOYSA-N
XLogP3.31
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.18
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(dimethylamino)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 110463533
N-[4-(N-hydroxy-C-methylcarbonimidoyl)-1,3-thiazol-2-yl]-2-iodobenzamide
CID 77046786
N-(4-methyl-1,3-thiazol-2-yl)-2-nitrobenzamide
CID 902953
4-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 885062
5-(hydroperoxyamino)-2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 59104321
2-amino-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 62060816
2-hydroxy-5-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 37018478
2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 107358521
2-N,6-N-bis(4-methyl-1,3-thiazol-2-yl)pyridine-2,6-dicarboxamide
CID 19684989
2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 2085562
N-(4-methyl-1,3-thiazol-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide
CID 26362259
2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46557524

Frequently Asked Questions

What is the IUPAC name of 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 884818) is 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide is Cc1csc(NC(=O)c2ccccc2I)n1.
What is the InChIKey of 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is PANMRGCRBNVTKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9IN2OS/c1-7-6-16-11(13-7)14-10(15)8-4-2-3-5-9(8)12/h2-6H,1H3,(H,13,14,15).
What are the key properties of 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 344.18 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 884818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).