3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide

C14H12INO3 — CID 79672942

IUPAC3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(I)c2)cc1O
InChIInChI=1S/C14H12INO3/c1-19-13-6-5-9(7-12(13)17)14(18)16-11-4-2-3-10(15)8-11/h2-8,17H,1H3,(H,16,18)
InChIKeyHEYXQWXKDXXRSI-UHFFFAOYSA-N
MW369.16 g/mol
LogP3.26
Rot. Bonds3

About 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide

3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide (PubChem CID 79672942) has the molecular formula C14H12INO3 and a molecular weight of 369.16 g/mol. Its IUPAC name is 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide.

Molecular Properties

Compound Name3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide
PubChem CID79672942
Molecular FormulaC14H12INO3
Molecular Weight369.16 g/mol
Exact Mass368.99
IUPAC Name3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(I)c2)cc1O
InChIInChI=1S/C14H12INO3/c1-19-13-6-5-9(7-12(13)17)14(18)16-11-4-2-3-10(15)8-11/h2-8,17H,1H3,(H,16,18)
InChIKeyHEYXQWXKDXXRSI-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 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide?
The IUPAC name of 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide (CID 79672942) is 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide.
What is the SMILES notation for 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide?
The canonical SMILES for 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2cccc(I)c2)cc1O.
What is the InChIKey of 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide?
The InChIKey is HEYXQWXKDXXRSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12INO3/c1-19-13-6-5-9(7-12(13)17)14(18)16-11-4-2-3-10(15)8-11/h2-8,17H,1H3,(H,16,18).
What are the key properties of 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide?
3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide 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 3-hydroxy-N-(3-iodophenyl)-4-methoxybenzamide is sourced from PubChem (CID 79672942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).