3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine

C9H12INO2 — CID 62706856

IUPAC3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine
SMILESCOCOc1cc(C)nc(C)c1I
InChIInChI=1S/C9H12INO2/c1-6-4-8(13-5-12-3)9(10)7(2)11-6/h4H,5H2,1-3H3
InChIKeyLJKPVMYCYGUKFY-UHFFFAOYSA-N
MW293.10 g/mol
LogP2.29
Rot. Bonds3

About 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine

3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine (PubChem CID 62706856) has the molecular formula C9H12INO2 and a molecular weight of 293.10 g/mol. Its IUPAC name is 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine.

Molecular Properties

Compound Name3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine
PubChem CID62706856
Molecular FormulaC9H12INO2
Molecular Weight293.10 g/mol
Exact Mass292.99
IUPAC Name3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine
SMILESCOCOc1cc(C)nc(C)c1I
InChIInChI=1S/C9H12INO2/c1-6-4-8(13-5-12-3)9(10)7(2)11-6/h4H,5H2,1-3H3
InChIKeyLJKPVMYCYGUKFY-UHFFFAOYSA-N
XLogP2.29
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.10
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-iodo-1-methoxy-3-(methoxymethoxy)-5-methylbenzene
CID 164886491
2-iodo-5-(methoxymethoxy)-1,3-dimethylbenzene
CID 150296892
2-bromo-4-iodo-3-(methoxymethoxy)-6-methylpyridine
CID 166167367
2-iodo-1-(methoxymethoxy)-3-methyl-5-(trifluoromethyl)benzene
CID 169066840
3-iodo-1-(methoxymethoxy)-2,4-dimethylbenzene
CID 171397463
2-iodo-1-(methoxymethoxy)-3,5-bis(trifluoromethyl)benzene
CID 163198277
4-iodo-2-methoxy-5-(methoxymethoxy)pyridine
CID 12027785
N-[[3-(methoxymethoxy)-6-methyl-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79156612
2-iodo-4-methoxy-1-(methoxymethoxy)benzene
CID 171366957
3-(methoxymethoxy)-2-methyl-6-[(E)-prop-1-enyl]pyridine
CID 58571037
methyl 2-[2-iodo-6-(4-methoxybenzoyl)-3,5-bis(methoxymethoxy)phenyl]acetate
CID 86610529
2-(methoxymethoxy)-6-methylpyridine
CID 150228028

Frequently Asked Questions

What is the IUPAC name of 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine?
The IUPAC name of 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine (CID 62706856) is 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine.
What is the SMILES notation for 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine?
The canonical SMILES for 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine is COCOc1cc(C)nc(C)c1I.
What is the InChIKey of 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine?
The InChIKey is LJKPVMYCYGUKFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12INO2/c1-6-4-8(13-5-12-3)9(10)7(2)11-6/h4H,5H2,1-3H3.
What are the key properties of 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine?
3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine has a molecular weight of 293.10 g/mol, XLogP of 2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-4-(methoxymethoxy)-2,6-dimethylpyridine is sourced from PubChem (CID 62706856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).