3-chloro-2-iodo-5,6-dimethoxypyridine

C7H7ClINO2 — CID 77230174

IUPAC3-chloro-2-iodo-5,6-dimethoxypyridine
SMILESCOc1cc(Cl)c(I)nc1OC
InChIInChI=1S/C7H7ClINO2/c1-11-5-3-4(8)6(9)10-7(5)12-2/h3H,1-2H3
InChIKeyKWNRLBWHPGFGAS-UHFFFAOYSA-N
MW299.50 g/mol
LogP2.36
Rot. Bonds2

About 3-chloro-2-iodo-5,6-dimethoxypyridine

3-chloro-2-iodo-5,6-dimethoxypyridine (PubChem CID 77230174) has the molecular formula C7H7ClINO2 and a molecular weight of 299.50 g/mol. Its IUPAC name is 3-chloro-2-iodo-5,6-dimethoxypyridine.

Molecular Properties

Compound Name3-chloro-2-iodo-5,6-dimethoxypyridine
PubChem CID77230174
Molecular FormulaC7H7ClINO2
Molecular Weight299.50 g/mol
Exact Mass298.92
IUPAC Name3-chloro-2-iodo-5,6-dimethoxypyridine
SMILESCOc1cc(Cl)c(I)nc1OC
InChIInChI=1S/C7H7ClINO2/c1-11-5-3-4(8)6(9)10-7(5)12-2/h3H,1-2H3
InChIKeyKWNRLBWHPGFGAS-UHFFFAOYSA-N
XLogP2.36
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.50
LogP ≤ 52.36
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'}

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Related Compounds

6-chloro-7-iodo-1,4-dimethoxyphthalazine
CID 15458077
2,3-dibromo-5,6-dimethoxypyridine
CID 23056693
5-chloro-2,3-dimethoxypyridine;hydrochloride
CID 91759024
1-chloro-5-fluoro-4-iodo-2-methoxybenzene
CID 22625607
1-chloro-2,4-difluoro-5-methoxybenzene
CID 124706419
4-chloro-3-(difluoromethyl)-6-iodo-2-methoxypyridine
CID 118805504
5-(difluoromethyl)-2-iodo-6-methoxy-3-(trifluoromethoxy)pyridine
CID 134666852
1,2,3,4-tetrachloro-5-methoxybenzene
CID 13649
(6-amino-5-chloro-2-methoxy-3-pyridinyl) methyl carbonate
CID 70188905
3-(difluoromethyl)-2-iodo-5-methoxy-6-(trifluoromethoxy)pyridine
CID 134680703
6-chloro-3-iodo-2-methoxypyridin-4-amine
CID 162736407
1-(2,5,6-trimethoxy-3-pyridinyl)ethanone
CID 71300170

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-iodo-5,6-dimethoxypyridine?
The IUPAC name of 3-chloro-2-iodo-5,6-dimethoxypyridine (CID 77230174) is 3-chloro-2-iodo-5,6-dimethoxypyridine.
What is the SMILES notation for 3-chloro-2-iodo-5,6-dimethoxypyridine?
The canonical SMILES for 3-chloro-2-iodo-5,6-dimethoxypyridine is COc1cc(Cl)c(I)nc1OC.
What is the InChIKey of 3-chloro-2-iodo-5,6-dimethoxypyridine?
The InChIKey is KWNRLBWHPGFGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClINO2/c1-11-5-3-4(8)6(9)10-7(5)12-2/h3H,1-2H3.
What are the key properties of 3-chloro-2-iodo-5,6-dimethoxypyridine?
3-chloro-2-iodo-5,6-dimethoxypyridine has a molecular weight of 299.50 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-iodo-5,6-dimethoxypyridine is sourced from PubChem (CID 77230174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).