2-chloro-4-iodopyridine-3-carbaldehyde

C6H3ClINO — CID 10038637

IUPAC2-chloro-4-iodopyridine-3-carbaldehyde
SMILESO=Cc1c(I)ccnc1Cl
InChIInChI=1S/C6H3ClINO/c7-6-4(3-10)5(8)1-2-9-6/h1-3H
InChIKeyOPZCXONVRBYGHX-UHFFFAOYSA-N
MW267.45 g/mol
LogP2.15
Rot. Bonds1

About 2-chloro-4-iodopyridine-3-carbaldehyde

2-chloro-4-iodopyridine-3-carbaldehyde (PubChem CID 10038637) has the molecular formula C6H3ClINO and a molecular weight of 267.45 g/mol. Its IUPAC name is 2-chloro-4-iodopyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-chloro-4-iodopyridine-3-carbaldehyde
PubChem CID10038637
Molecular FormulaC6H3ClINO
Molecular Weight267.45 g/mol
Exact Mass266.89
IUPAC Name2-chloro-4-iodopyridine-3-carbaldehyde
SMILESO=Cc1c(I)ccnc1Cl
InChIInChI=1S/C6H3ClINO/c7-6-4(3-10)5(8)1-2-9-6/h1-3H
InChIKeyOPZCXONVRBYGHX-UHFFFAOYSA-N
XLogP2.15
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.45
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-iodopyridine-3-carbaldehyde?
The IUPAC name of 2-chloro-4-iodopyridine-3-carbaldehyde (CID 10038637) is 2-chloro-4-iodopyridine-3-carbaldehyde.
What is the SMILES notation for 2-chloro-4-iodopyridine-3-carbaldehyde?
The canonical SMILES for 2-chloro-4-iodopyridine-3-carbaldehyde is O=Cc1c(I)ccnc1Cl.
What is the InChIKey of 2-chloro-4-iodopyridine-3-carbaldehyde?
The InChIKey is OPZCXONVRBYGHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClINO/c7-6-4(3-10)5(8)1-2-9-6/h1-3H.
What are the key properties of 2-chloro-4-iodopyridine-3-carbaldehyde?
2-chloro-4-iodopyridine-3-carbaldehyde has a molecular weight of 267.45 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-iodopyridine-3-carbaldehyde is sourced from PubChem (CID 10038637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).