2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide

C12H7Cl2IN2O — CID 23440185

IUPAC2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(I)cn1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H7Cl2IN2O/c13-8-2-1-3-9(14)11(8)12(18)17-10-5-4-7(15)6-16-10/h1-6H,(H,16,17,18)
InChIKeyPYYYERHOXLUHNW-UHFFFAOYSA-N
MW393.01 g/mol
LogP4.25
Rot. Bonds2

About 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide

2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide (PubChem CID 23440185) has the molecular formula C12H7Cl2IN2O and a molecular weight of 393.01 g/mol. Its IUPAC name is 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
PubChem CID23440185
Molecular FormulaC12H7Cl2IN2O
Molecular Weight393.01 g/mol
Exact Mass391.90
IUPAC Name2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(I)cn1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H7Cl2IN2O/c13-8-2-1-3-9(14)11(8)12(18)17-10-5-4-7(15)6-16-10/h1-6H,(H,16,17,18)
InChIKeyPYYYERHOXLUHNW-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'}

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Related Compounds

3-chloro-N-(5-iodo-2-pyridinyl)-2-methylbenzamide
CID 107096909
1-(2-chlorophenyl)-3-(5-iodo-2-pyridinyl)urea
CID 65098518
3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 65098988
2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide
CID 23345083
6-[(2-chloro-6-methylbenzoyl)amino]pyridine-3-carboxylic acid
CID 137373603
5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide
CID 65098648
2-chloro-5-iodo-N-[(5-iodo-2-pyridinyl)carbamothioyl]benzamide
CID 4504034
2-chloro-N-(5-iodo-2-pyridinyl)-6-methylpyrimidine-4-carboxamide
CID 114219747
N-(5-anilino-2-pyridinyl)-2-chloro-6-fluorobenzamide
CID 113031217
2,6-dichloro-N-(2,4-dichloropyrimidin-5-yl)benzamide
CID 169100604
2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide
CID 134102994
3-cyano-N-(5-iodo-2-pyridinyl)benzamide
CID 65098930

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
The IUPAC name of 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide (CID 23440185) is 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide is O=C(Nc1ccc(I)cn1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
The InChIKey is PYYYERHOXLUHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2IN2O/c13-8-2-1-3-9(14)11(8)12(18)17-10-5-4-7(15)6-16-10/h1-6H,(H,16,17,18).
What are the key properties of 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide?
2,6-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 2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide is sourced from PubChem (CID 23440185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).