3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide

C12H7Cl2IN2O — CID 65098988

IUPAC3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(I)cn1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H7Cl2IN2O/c13-8-3-7(4-9(14)5-8)12(18)17-11-2-1-10(15)6-16-11/h1-6H,(H,16,17,18)
InChIKeyKFAUTSWAQBZVIJ-UHFFFAOYSA-N
MW393.01 g/mol
LogP4.25
Rot. Bonds2

About 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide

3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide (PubChem CID 65098988) has the molecular formula C12H7Cl2IN2O and a molecular weight of 393.01 g/mol. Its IUPAC name is 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide
PubChem CID65098988
Molecular FormulaC12H7Cl2IN2O
Molecular Weight393.01 g/mol
Exact Mass391.90
IUPAC Name3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(I)cn1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H7Cl2IN2O/c13-8-3-7(4-9(14)5-8)12(18)17-11-2-1-10(15)6-16-11/h1-6H,(H,16,17,18)
InChIKeyKFAUTSWAQBZVIJ-UHFFFAOYSA-N
XLogP4.25
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.01
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dichloro-N-(5-methyl-2-pyridinyl)benzamide
CID 5063171
3,5-dichloro-N-(5-chloropyrazin-2-yl)benzamide
CID 104964163
2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 23440185
N-(5-iodo-2-pyridinyl)naphthalene-2-carboxamide
CID 60674580
3,4,5-triethoxy-N-(5-iodo-2-pyridinyl)benzamide
CID 2232052
2-chloro-N-(5-iodo-2-pyridinyl)-6-methylpyrimidine-4-carboxamide
CID 114219747
3,5-dichloro-N-(6-chloropyridazin-3-yl)benzamide
CID 113230922
N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide
CID 65098497
3-cyano-N-(5-iodo-2-pyridinyl)benzamide
CID 65098930
3,4-dichloro-N-[(5-iodo-2-pyridinyl)carbamothioyl]benzamide
CID 4504032
3-chloro-N-(5-iodo-2-pyridinyl)-2-methylbenzamide
CID 107096909
N-(5-bromo-2-pyridinyl)-4-iodobenzamide
CID 4066488

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
The IUPAC name of 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide (CID 65098988) is 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide.
What is the SMILES notation for 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
The canonical SMILES for 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide is O=C(Nc1ccc(I)cn1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
The InChIKey is KFAUTSWAQBZVIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2IN2O/c13-8-3-7(4-9(14)5-8)12(18)17-11-2-1-10(15)6-16-11/h1-6H,(H,16,17,18).
What are the key properties of 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide has a molecular weight of 393.01 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide is sourced from PubChem (CID 65098988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).