5-Iodo-2-methoxy-4,6-dimethylpyridine-3-carbonitrile

HCID 56777511

Basic information

Standard SMILES
COc1nc(C)c(I)c(C)c1C#N
InChIKey
KQQZSIHWXLUEMQ-UHFFFAOYSA-N
Molecular formula
C9H9IN2O
Average molar mass
288.08 g/mol

Names & identifiers

Preferred name
5-Iodo-2-methoxy-4,6-dimethylpyridine-3-carbonitrile
IUPAC
5-iodo-2-methoxy-4,6-dimethylpyridine-3-carbonitrile

Names & synonyms

858120-02-25-iodo-2-methoxy-4,6-dimethylpyridine-3-carbonitrile5-Iodo-2-methoxy-4,6-dimethylnicotinonitrileMFCD205263285-iodo-2-methoxy-4,6-dimethyl-nicotinonitrileSCHEMBL4075864KQQZSIHWXLUEMQ-UHFFFAOYSA-NAKOS015991226AE-0723CS-04562955-iodo-2-methoxy-4,6-dimethyl-pyridine-3-carbonitrile

Database identifiers

PubChem CID
56777511

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
45.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13

Related reactions

4 records

Compound notes

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