2-iodododecanamide

C12H24INO — CID 57350654

IUPAC2-iodododecanamide
SMILESCCCCCCCCCCC(I)C(N)=O
InChIInChI=1S/C12H24INO/c1-2-3-4-5-6-7-8-9-10-11(13)12(14)15/h11H,2-10H2,1H3,(H2,14,15)
InChIKeyLVOKRQGWEPOURA-UHFFFAOYSA-N
MW325.23 g/mol
LogP3.81
Rot. Bonds10

About 2-iodododecanamide

2-iodododecanamide (PubChem CID 57350654) has the molecular formula C12H24INO and a molecular weight of 325.23 g/mol. Its IUPAC name is 2-iodododecanamide.

Molecular Properties

Compound Name2-iodododecanamide
PubChem CID57350654
Molecular FormulaC12H24INO
Molecular Weight325.23 g/mol
Exact Mass325.09
IUPAC Name2-iodododecanamide
SMILESCCCCCCCCCCC(I)C(N)=O
InChIInChI=1S/C12H24INO/c1-2-3-4-5-6-7-8-9-10-11(13)12(14)15/h11H,2-10H2,1H3,(H2,14,15)
InChIKeyLVOKRQGWEPOURA-UHFFFAOYSA-N
XLogP3.81
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.23
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-iododecanoyl 2-iododecanoate
CID 171061308
2-iodotetradecanoic acid
CID 536352
bromo 2-iodooctanoate
CID 174726044
2-hexyloctanamide
CID 87302701
2-octyldecanamide
CID 19104479
2-dodecylnonadecanamide
CID 175503182
sodium 2-iodododecanoate
CID 141360253
potassium 2-iodononanoate
CID 141360310
sodium 2-iodononanoate
CID 141360284
2-butyltetradecanamide
CID 57191211
2-butyldodecanamide
CID 88685822
2-hydroxyoctadecanamide
CID 14598043

Frequently Asked Questions

What is the IUPAC name of 2-iodododecanamide?
The IUPAC name of 2-iodododecanamide (CID 57350654) is 2-iodododecanamide.
What is the SMILES notation for 2-iodododecanamide?
The canonical SMILES for 2-iodododecanamide is CCCCCCCCCCC(I)C(N)=O.
What is the InChIKey of 2-iodododecanamide?
The InChIKey is LVOKRQGWEPOURA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24INO/c1-2-3-4-5-6-7-8-9-10-11(13)12(14)15/h11H,2-10H2,1H3,(H2,14,15).
What are the key properties of 2-iodododecanamide?
2-iodododecanamide has a molecular weight of 325.23 g/mol, XLogP of 3.81, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodododecanamide is sourced from PubChem (CID 57350654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).