2-(dimethylamino)-N-iodo-2-methylpropanamide

C6H13IN2O — CID 175630781

IUPAC2-(dimethylamino)-N-iodo-2-methylpropanamide
SMILESCN(C)C(C)(C)C(=O)NI
InChIInChI=1S/C6H13IN2O/c1-6(2,9(3)4)5(10)8-7/h1-4H3,(H,8,10)
InChIKeyUGJZJLIROIEOON-UHFFFAOYSA-N
MW256.09 g/mol
LogP0.79
Rot. Bonds2

About 2-(dimethylamino)-N-iodo-2-methylpropanamide

2-(dimethylamino)-N-iodo-2-methylpropanamide (PubChem CID 175630781) has the molecular formula C6H13IN2O and a molecular weight of 256.09 g/mol. Its IUPAC name is 2-(dimethylamino)-N-iodo-2-methylpropanamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-iodo-2-methylpropanamide
PubChem CID175630781
Molecular FormulaC6H13IN2O
Molecular Weight256.09 g/mol
Exact Mass256.01
IUPAC Name2-(dimethylamino)-N-iodo-2-methylpropanamide
SMILESCN(C)C(C)(C)C(=O)NI
InChIInChI=1S/C6H13IN2O/c1-6(2,9(3)4)5(10)8-7/h1-4H3,(H,8,10)
InChIKeyUGJZJLIROIEOON-UHFFFAOYSA-N
XLogP0.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.09
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-iodo-2-methylpropanamide?
The IUPAC name of 2-(dimethylamino)-N-iodo-2-methylpropanamide (CID 175630781) is 2-(dimethylamino)-N-iodo-2-methylpropanamide.
What is the SMILES notation for 2-(dimethylamino)-N-iodo-2-methylpropanamide?
The canonical SMILES for 2-(dimethylamino)-N-iodo-2-methylpropanamide is CN(C)C(C)(C)C(=O)NI.
What is the InChIKey of 2-(dimethylamino)-N-iodo-2-methylpropanamide?
The InChIKey is UGJZJLIROIEOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13IN2O/c1-6(2,9(3)4)5(10)8-7/h1-4H3,(H,8,10).
What are the key properties of 2-(dimethylamino)-N-iodo-2-methylpropanamide?
2-(dimethylamino)-N-iodo-2-methylpropanamide has a molecular weight of 256.09 g/mol, XLogP of 0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-iodo-2-methylpropanamide is sourced from PubChem (CID 175630781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).