N-(4-Iodo-6-methoxy-3-pyridinyl)-2,2-dimethylpropanamide

HCID 21581652

Notes Reactions

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Basic information

CAS: 227180-20-3
Standard SMILES: COc1cc(I)c(NC(=O)C(C)(C)C)cn1
InChIKey: OJMNZOTXPXTTHY-UHFFFAOYSA-N
Molecular formula: C11H15IN2O2
Average molar mass: 334.15 g/mol
Monoisotopic mass: 334.01782572

Names & identifiers

Preferred name: N-(4-Iodo-6-methoxy-3-pyridinyl)-2,2-dimethylpropanamide
IUPAC: N-(4-iodo-6-methoxy-3-pyridinyl)-2,2-dimethylpropanamide

Names & synonyms

227180-20-3N-(4-Iodo-6-methoxy-3-pyridinyl)-2,2-dimethylpropanamideRefChem:362037N-(4-iodo-6-methoxypyridin-3-yl)pivalamideN-(4-iodo-6-methoxypyridin-3-yl)-2,2-dimethylpropanamideSCHEMBL1352170OJMNZOTXPXTTHY-UHFFFAOYSA-NDTXSID901200264

Database identifiers

CAS: 227180-20-3
PubChem CID: 21581652
DTXSID: DTXSID901200264

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 51.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 253

Related reactions

7 records

New reaction record

HRID 43259As productuspto-grants-2013_09

HRID 43260As reactantuspto-grants-2013_09

HRID 906383As productuspto-grants-2011_09

HRID 906384As reactantuspto-grants-2011_09

HRID 958764As reactantValidation data from https://doi.org/10.1039/C8SC04228D

HRID 2384489As productuspto-grants-2012_09

HRID 2384490As reactantuspto-grants-2012_09

Compound notes

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