2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide

C14H12INO3 — CID 27228916

IUPAC2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cc(I)ccc2O)cc1
InChIInChI=1S/C14H12INO3/c1-19-11-5-3-10(4-6-11)16-14(18)12-8-9(15)2-7-13(12)17/h2-8,17H,1H3,(H,16,18)
InChIKeyWJUFTZFAQYHROG-UHFFFAOYSA-N
MW369.16 g/mol
LogP3.26
Rot. Bonds3

About 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide

2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide (PubChem CID 27228916) has the molecular formula C14H12INO3 and a molecular weight of 369.16 g/mol. Its IUPAC name is 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide
PubChem CID27228916
Molecular FormulaC14H12INO3
Molecular Weight369.16 g/mol
Exact Mass368.99
IUPAC Name2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cc(I)ccc2O)cc1
InChIInChI=1S/C14H12INO3/c1-19-11-5-3-10(4-6-11)16-14(18)12-8-9(15)2-7-13(12)17/h2-8,17H,1H3,(H,16,18)
InChIKeyWJUFTZFAQYHROG-UHFFFAOYSA-N
XLogP3.26
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.16
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide?
The IUPAC name of 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide (CID 27228916) is 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide?
The canonical SMILES for 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide is COc1ccc(NC(=O)c2cc(I)ccc2O)cc1.
What is the InChIKey of 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide?
The InChIKey is WJUFTZFAQYHROG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12INO3/c1-19-11-5-3-10(4-6-11)16-14(18)12-8-9(15)2-7-13(12)17/h2-8,17H,1H3,(H,16,18).
What are the key properties of 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide?
2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide has a molecular weight of 369.16 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-iodo-N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 27228916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).