4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide

C12H7ClFIN2O — CID 113340906

IUPAC4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)c1I)c1cc(Cl)ccn1
InChIInChI=1S/C12H7ClFIN2O/c13-7-4-5-16-10(6-7)12(18)17-9-3-1-2-8(14)11(9)15/h1-6H,(H,17,18)
InChIKeyZMMJFSCHYCKZKL-UHFFFAOYSA-N
MW376.56 g/mol
LogP3.73
Rot. Bonds2

About 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide

4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide (PubChem CID 113340906) has the molecular formula C12H7ClFIN2O and a molecular weight of 376.56 g/mol. Its IUPAC name is 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide
PubChem CID113340906
Molecular FormulaC12H7ClFIN2O
Molecular Weight376.56 g/mol
Exact Mass375.93
IUPAC Name4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)c1I)c1cc(Cl)ccn1
InChIInChI=1S/C12H7ClFIN2O/c13-7-4-5-16-10(6-7)12(18)17-9-3-1-2-8(14)11(9)15/h1-6H,(H,17,18)
InChIKeyZMMJFSCHYCKZKL-UHFFFAOYSA-N
XLogP3.73
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.56
LogP ≤ 53.73
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

4-chloro-N-(5-chloro-2-fluorophenyl)pyridine-2-carboxamide
CID 43385379
4-chloro-N-[2-[(4-chloropyridine-2-carbonyl)amino]phenyl]pyridine-2-carboxamide
CID 102274363
4-chloro-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 43580727
4-chloro-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 30430877
4-chloro-N-(2-hydroxyphenyl)pyridine-2-carboxamide
CID 35852171
4-chloro-N-(2,3,4,5,6-pentafluorophenyl)pyridine-2-carboxamide
CID 115279672
2-N-(3-chlorophenyl)-4-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092592
3-[(4-chloropyridine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 104740156
5-bromo-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide
CID 113340903
2-[2-[(4-chloropyridine-2-carbonyl)amino]phenyl]acetic acid
CID 62535920
4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-3-carboxamide
CID 114258700
N-(2-bromo-5-fluorophenyl)-4-chloropyridine-2-carboxamide
CID 103753577

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide (CID 113340906) is 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide is O=C(Nc1cccc(F)c1I)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide?
The InChIKey is ZMMJFSCHYCKZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClFIN2O/c13-7-4-5-16-10(6-7)12(18)17-9-3-1-2-8(14)11(9)15/h1-6H,(H,17,18).
What are the key properties of 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide?
4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide has a molecular weight of 376.56 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-fluoro-2-iodophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 113340906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).