2-iodo-6-(oxan-4-yloxy)pyridine

C10H12INO2 — CID 170247285

IUPAC2-iodo-6-(oxan-4-yloxy)pyridine
SMILESIc1cccc(OC2CCOCC2)n1
InChIInChI=1S/C10H12INO2/c11-9-2-1-3-10(12-9)14-8-4-6-13-7-5-8/h1-3,8H,4-7H2
InChIKeyRHZNWWZUBWUFNW-UHFFFAOYSA-N
MW305.11 g/mol
LogP2.24
Rot. Bonds2

About 2-iodo-6-(oxan-4-yloxy)pyridine

2-iodo-6-(oxan-4-yloxy)pyridine (PubChem CID 170247285) has the molecular formula C10H12INO2 and a molecular weight of 305.11 g/mol. Its IUPAC name is 2-iodo-6-(oxan-4-yloxy)pyridine.

Molecular Properties

Compound Name2-iodo-6-(oxan-4-yloxy)pyridine
PubChem CID170247285
Molecular FormulaC10H12INO2
Molecular Weight305.11 g/mol
Exact Mass304.99
IUPAC Name2-iodo-6-(oxan-4-yloxy)pyridine
SMILESIc1cccc(OC2CCOCC2)n1
InChIInChI=1S/C10H12INO2/c11-9-2-1-3-10(12-9)14-8-4-6-13-7-5-8/h1-3,8H,4-7H2
InChIKeyRHZNWWZUBWUFNW-UHFFFAOYSA-N
XLogP2.24
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.11
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-iodo-6-(oxan-4-yloxy)pyridine 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

N-ethyl-6-(oxan-4-yloxy)pyridin-2-amine
CID 80872431
3-iodo-6-(oxan-4-yloxy)pyridazine
CID 59277431
3-chloro-2-fluoro-6-(oxan-4-yloxy)pyridine
CID 125116478
2-fluoro-6-(oxan-4-yloxy)pyridin-3-ol
CID 125116313
3-iodo-6-[(3R)-oxolan-3-yl]oxypyridazine
CID 59277501
4-phenoxyoxane
CID 58483739
3-chloro-6-(oxan-4-yloxy)pyridazine
CID 53256682
6-(oxan-4-yloxy)pyridin-3-amine
CID 51063694
2-cyclopentyloxy-6-fluoropyridine
CID 61227788
N-methyl-6-(1-methylpiperidin-4-yl)oxypyridin-2-amine
CID 45097725
2-fluoro-6-(oxetan-3-yloxy)pyridine
CID 102606191
2-(oxan-4-yloxy)quinazolin-4-amine
CID 123642134

Frequently Asked Questions

What is the IUPAC name of 2-iodo-6-(oxan-4-yloxy)pyridine?
The IUPAC name of 2-iodo-6-(oxan-4-yloxy)pyridine (CID 170247285) is 2-iodo-6-(oxan-4-yloxy)pyridine.
What is the SMILES notation for 2-iodo-6-(oxan-4-yloxy)pyridine?
The canonical SMILES for 2-iodo-6-(oxan-4-yloxy)pyridine is Ic1cccc(OC2CCOCC2)n1.
What is the InChIKey of 2-iodo-6-(oxan-4-yloxy)pyridine?
The InChIKey is RHZNWWZUBWUFNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12INO2/c11-9-2-1-3-10(12-9)14-8-4-6-13-7-5-8/h1-3,8H,4-7H2.
What are the key properties of 2-iodo-6-(oxan-4-yloxy)pyridine?
2-iodo-6-(oxan-4-yloxy)pyridine has a molecular weight of 305.11 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-6-(oxan-4-yloxy)pyridine is sourced from PubChem (CID 170247285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).