2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde

C7H4F2INO — CID 118820492

IUPAC2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde
SMILESO=Cc1cc(I)cnc1C(F)F
InChIInChI=1S/C7H4F2INO/c8-7(9)6-4(3-12)1-5(10)2-11-6/h1-3,7H
InChIKeyKLWCUVMAKZDWNA-UHFFFAOYSA-N
MW283.01 g/mol
LogP2.44
Rot. Bonds2

About 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde

2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde (PubChem CID 118820492) has the molecular formula C7H4F2INO and a molecular weight of 283.01 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde
PubChem CID118820492
Molecular FormulaC7H4F2INO
Molecular Weight283.01 g/mol
Exact Mass282.93
IUPAC Name2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde
SMILESO=Cc1cc(I)cnc1C(F)F
InChIInChI=1S/C7H4F2INO/c8-7(9)6-4(3-12)1-5(10)2-11-6/h1-3,7H
InChIKeyKLWCUVMAKZDWNA-UHFFFAOYSA-N
XLogP2.44
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.01
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-5-iodopyridine-3-carbaldehyde
CID 126569658
2-(difluoromethyl)-5-iodopyridin-3-amine
CID 130094620
6-(difluoromethyl)-4,5-difluoropyridine-3-carbaldehyde
CID 130099857
2-(difluoromethyl)-5-iodopyridine-3-carboxamide
CID 118837602
2-(difluoromethyl)-5-fluoro-4-iodopyridine-3-carbaldehyde
CID 118854258
5-amino-6-(difluoromethyl)-4-fluoropyridine-3-carbaldehyde
CID 130104215
4-amino-6-(difluoromethyl)-5-fluoropyridine-3-carbaldehyde
CID 118851291
2-(difluoromethyl)-6-iodo-5-methoxypyridine-3-carbaldehyde
CID 130085753
4-amino-6-(difluoromethyl)-5-hydroxypyridine-3-carbaldehyde
CID 118845258
4-chloro-6-(difluoromethyl)-5-methylpyridine-3-carbaldehyde
CID 118822221
4-bromo-5-chloro-6-(difluoromethyl)pyridine-3-carbaldehyde
CID 118811578
5-(chloromethyl)-2-(difluoromethyl)-3-iodopyridine-4-carbaldehyde
CID 130087542

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde?
The IUPAC name of 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde (CID 118820492) is 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde.
What is the SMILES notation for 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde?
The canonical SMILES for 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde is O=Cc1cc(I)cnc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde?
The InChIKey is KLWCUVMAKZDWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F2INO/c8-7(9)6-4(3-12)1-5(10)2-11-6/h1-3,7H.
What are the key properties of 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde?
2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde has a molecular weight of 283.01 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde is sourced from PubChem (CID 118820492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).