2-(iodomethyl)-N,N-dimethylprop-2-enamide

C6H10INO — CID 11843066

IUPAC2-(iodomethyl)-N,N-dimethylprop-2-enamide
SMILESC=C(CI)C(=O)N(C)C
InChIInChI=1S/C6H10INO/c1-5(4-7)6(9)8(2)3/h1,4H2,2-3H3
InChIKeyOZCMOMCIPRYZOJ-UHFFFAOYSA-N
MW239.06 g/mol
LogP1.07
Rot. Bonds2

About 2-(iodomethyl)-N,N-dimethylprop-2-enamide

2-(iodomethyl)-N,N-dimethylprop-2-enamide (PubChem CID 11843066) has the molecular formula C6H10INO and a molecular weight of 239.06 g/mol. Its IUPAC name is 2-(iodomethyl)-N,N-dimethylprop-2-enamide.

Molecular Properties

Compound Name2-(iodomethyl)-N,N-dimethylprop-2-enamide
PubChem CID11843066
Molecular FormulaC6H10INO
Molecular Weight239.06 g/mol
Exact Mass238.98
IUPAC Name2-(iodomethyl)-N,N-dimethylprop-2-enamide
SMILESC=C(CI)C(=O)N(C)C
InChIInChI=1S/C6H10INO/c1-5(4-7)6(9)8(2)3/h1,4H2,2-3H3
InChIKeyOZCMOMCIPRYZOJ-UHFFFAOYSA-N
XLogP1.07
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.06
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-2-methylidenedodecanamide
CID 88681161
azane;N,N,2-trimethylprop-2-enamide
CID 162327856
2-(methoxymethoxymethyl)-N,N-dimethylprop-2-enamide
CID 20770092
CID 58987178
CID 58987178
2-benzyl-N,N-dimethylprop-2-enamide
CID 67100318
N-(iodomethyl)-N,2-dimethylprop-2-enamide
CID 146497620
3,3-diiodo-N,N-dimethyl-2-oxobutanamide
CID 155470286
N,N,3-trimethyl-2-methylidenebutanamide
CID 57080569
2,2,2-tris(dimethylamino)-N,N-dimethylacetamide
CID 87823120
N-[4-(tert-butylcarbamoyl)-2-methylpent-4-en-2-yl]-N',N'-dimethyloxamide
CID 138602873
N-hydroxy-N-methyl-2-methylidenebutanamide
CID 22624762
N,N,4,4-tetramethyl-2-oxopentanamide
CID 158996927

Frequently Asked Questions

What is the IUPAC name of 2-(iodomethyl)-N,N-dimethylprop-2-enamide?
The IUPAC name of 2-(iodomethyl)-N,N-dimethylprop-2-enamide (CID 11843066) is 2-(iodomethyl)-N,N-dimethylprop-2-enamide.
What is the SMILES notation for 2-(iodomethyl)-N,N-dimethylprop-2-enamide?
The canonical SMILES for 2-(iodomethyl)-N,N-dimethylprop-2-enamide is C=C(CI)C(=O)N(C)C.
What is the InChIKey of 2-(iodomethyl)-N,N-dimethylprop-2-enamide?
The InChIKey is OZCMOMCIPRYZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10INO/c1-5(4-7)6(9)8(2)3/h1,4H2,2-3H3.
What are the key properties of 2-(iodomethyl)-N,N-dimethylprop-2-enamide?
2-(iodomethyl)-N,N-dimethylprop-2-enamide has a molecular weight of 239.06 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(iodomethyl)-N,N-dimethylprop-2-enamide is sourced from PubChem (CID 11843066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).