N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide

C7H16INO — CID 163825118

IUPACN-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)I(C)C
InChIInChI=1S/C7H16INO/c1-6(10)9-7(2,3)8(4)5/h1-5H3,(H,9,10)
InChIKeyNYUOYWMLRQIMJM-UHFFFAOYSA-N
MW257.11 g/mol
LogP1.62
Rot. Bonds2

About N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide

N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide (PubChem CID 163825118) has the molecular formula C7H16INO and a molecular weight of 257.11 g/mol. Its IUPAC name is N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide.

Molecular Properties

Compound NameN-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide
PubChem CID163825118
Molecular FormulaC7H16INO
Molecular Weight257.11 g/mol
Exact Mass257.03
IUPAC NameN-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)I(C)C
InChIInChI=1S/C7H16INO/c1-6(10)9-7(2,3)8(4)5/h1-5H3,(H,9,10)
InChIKeyNYUOYWMLRQIMJM-UHFFFAOYSA-N
XLogP1.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.11
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-acetamido-2-methyl-3-oxobutanoate
CID 87370623
methyl 3-acetamido-2,2,3-trimethylbutanoate
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ethane;N-(2-methylbutan-2-yl)acetamide
CID 142252022
N-(6-acetamido-2,6-dimethyl-4-oxoheptan-2-yl)acetamide
CID 139120888
2-acetamido-N-acetyl-2-methylpropanamide
CID 130013790
(2-acetamido-2-methylpropanoyl)azanide;rutherfordium
CID 59913948
2-acetamido-2-hydroxypropanedioic acid
CID 45122281
(2S)-2-acetamido-2-methylbutanoic acid
CID 71355971
N-[2-methyl-3-(methylamino)butan-2-yl]acetamide
CID 170339118
methyl 2-acetamido-2,4-dimethylpentanoate
CID 24978228
methyl (2S,3S)-2-acetamido-3-hydroxy-2,4-dimethylpentanoate
CID 11424486
N-[1-(dimethylamino)-2-methylpropan-2-yl]acetamide;ethane
CID 145224107

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide?
The IUPAC name of N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide (CID 163825118) is N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide.
What is the SMILES notation for N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide?
The canonical SMILES for N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide is CC(=O)NC(C)(C)I(C)C.
What is the InChIKey of N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide?
The InChIKey is NYUOYWMLRQIMJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16INO/c1-6(10)9-7(2,3)8(4)5/h1-5H3,(H,9,10).
What are the key properties of N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide?
N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide has a molecular weight of 257.11 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethyl-λ3-iodanyl)propan-2-yl]acetamide is sourced from PubChem (CID 163825118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).