N-(4-iodophenyl)-2,6-dimethoxybenzamide

C15H14INO3 — CID 1019212

IUPACN-(4-iodophenyl)-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1ccc(I)cc1
InChIInChI=1S/C15H14INO3/c1-19-12-4-3-5-13(20-2)14(12)15(18)17-11-8-6-10(16)7-9-11/h3-9H,1-2H3,(H,17,18)
InChIKeyXLDMHOFTEZDYJF-UHFFFAOYSA-N
MW383.19 g/mol
LogP3.56
Rot. Bonds4

About N-(4-iodophenyl)-2,6-dimethoxybenzamide

N-(4-iodophenyl)-2,6-dimethoxybenzamide (PubChem CID 1019212) has the molecular formula C15H14INO3 and a molecular weight of 383.19 g/mol. Its IUPAC name is N-(4-iodophenyl)-2,6-dimethoxybenzamide.

Molecular Properties

Compound NameN-(4-iodophenyl)-2,6-dimethoxybenzamide
PubChem CID1019212
Molecular FormulaC15H14INO3
Molecular Weight383.19 g/mol
Exact Mass383.00
IUPAC NameN-(4-iodophenyl)-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1ccc(I)cc1
InChIInChI=1S/C15H14INO3/c1-19-12-4-3-5-13(20-2)14(12)15(18)17-11-8-6-10(16)7-9-11/h3-9H,1-2H3,(H,17,18)
InChIKeyXLDMHOFTEZDYJF-UHFFFAOYSA-N
XLogP3.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.19
LogP ≤ 53.56
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-fluoro-N-(4-iodophenyl)-6-methoxybenzamide
CID 65432477
N-(4-ethylphenyl)-2,6-dimethoxybenzamide
CID 596670
N-(4-carbamoylphenyl)-2,6-dimethoxybenzamide
CID 4126051
N-[4-(1-aminoethyl)phenyl]-2,6-dimethoxybenzamide
CID 43822918
2,6-dimethoxy-N-(4-sulfamoylphenyl)benzamide
CID 954656
N-[4-(butanoylamino)phenyl]-2,6-dimethoxybenzamide
CID 954631
2,6-dimethoxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 110776411
2,6-dimethoxy-N-[4-[(2-methylphenyl)carbamoyl]phenyl]benzamide
CID 142804897
N-(3-fluoro-4-methoxyphenyl)-2,6-dimethoxybenzamide
CID 110776470
2,6-dimethoxy-N-[4-(2-methylanilino)phenyl]benzamide
CID 112985879
N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,6-dimethoxybenzamide
CID 22775702
N-[4-(benzylamino)phenyl]-2,6-dimethoxybenzamide
CID 112981913

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-2,6-dimethoxybenzamide?
The IUPAC name of N-(4-iodophenyl)-2,6-dimethoxybenzamide (CID 1019212) is N-(4-iodophenyl)-2,6-dimethoxybenzamide.
What is the SMILES notation for N-(4-iodophenyl)-2,6-dimethoxybenzamide?
The canonical SMILES for N-(4-iodophenyl)-2,6-dimethoxybenzamide is COc1cccc(OC)c1C(=O)Nc1ccc(I)cc1.
What is the InChIKey of N-(4-iodophenyl)-2,6-dimethoxybenzamide?
The InChIKey is XLDMHOFTEZDYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14INO3/c1-19-12-4-3-5-13(20-2)14(12)15(18)17-11-8-6-10(16)7-9-11/h3-9H,1-2H3,(H,17,18).
What are the key properties of N-(4-iodophenyl)-2,6-dimethoxybenzamide?
N-(4-iodophenyl)-2,6-dimethoxybenzamide has a molecular weight of 383.19 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-2,6-dimethoxybenzamide is sourced from PubChem (CID 1019212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).