4-(125I)iodo-N-prop-2-enyl(125I)benzamide

C10H10INO — CID 118652264

IUPAC4-(125I)iodo-N-prop-2-enyl(125I)benzamide
SMILESC=CCNC(=O)c1ccc([125I])cc1
InChIInChI=1S/C10H10INO/c1-2-7-12-10(13)8-3-5-9(11)6-4-8/h2-6H,1,7H2,(H,12,13)/i11-2
InChIKeyDTRHPOUILNLLNZ-GQCOAOBCSA-N
MW285.10 g/mol
LogP2.21
Rot. Bonds3

About 4-(125I)iodo-N-prop-2-enyl(125I)benzamide

4-(125I)iodo-N-prop-2-enyl(125I)benzamide (PubChem CID 118652264) has the molecular formula C10H10INO and a molecular weight of 285.10 g/mol. Its IUPAC name is 4-(125I)iodo-N-prop-2-enyl(125I)benzamide.

Molecular Properties

Compound Name4-(125I)iodo-N-prop-2-enyl(125I)benzamide
PubChem CID118652264
Molecular FormulaC10H10INO
Molecular Weight285.10 g/mol
Exact Mass284.98
IUPAC Name4-(125I)iodo-N-prop-2-enyl(125I)benzamide
SMILESC=CCNC(=O)c1ccc([125I])cc1
InChIInChI=1S/C10H10INO/c1-2-7-12-10(13)8-3-5-9(11)6-4-8/h2-6H,1,7H2,(H,12,13)/i11-2
InChIKeyDTRHPOUILNLLNZ-GQCOAOBCSA-N
XLogP2.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.10
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-(125I)iodo-N-prop-2-enyl(125I)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-prop-2-enyl-4-[4-(prop-2-enylcarbamoyl)phenyl]benzamide
CID 3714314
4-hydrazinyl-N-prop-2-enylbenzamide
CID 138742315
1-N,3-N,5-N-tris(prop-2-enyl)benzene-1,3,5-tricarboxamide
CID 54451991
4-formamido-N-prop-2-enylbenzamide
CID 64992358
4-N-(4-acetamidophenyl)-1-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043595
4-methylsulfonyl-N-prop-2-enylbenzamide
CID 9442193
4-[(2,2-difluoroacetyl)amino]-N-prop-2-enylbenzamide
CID 103515175
N-prop-2-enyl-4-(trifluoromethoxy)benzamide
CID 22616308
N-prop-2-enyl-4-(sulfamoylamino)benzamide
CID 112573721
4-N-[(4-chlorophenyl)methyl]-1-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043482
4-(methylsulfonylmethyl)-N-prop-2-enylbenzamide
CID 9442194
N-prop-2-enyl-4-[(2,2,2-trifluoroacetyl)amino]benzamide
CID 62726927

Frequently Asked Questions

What is the IUPAC name of 4-(125I)iodo-N-prop-2-enyl(125I)benzamide?
The IUPAC name of 4-(125I)iodo-N-prop-2-enyl(125I)benzamide (CID 118652264) is 4-(125I)iodo-N-prop-2-enyl(125I)benzamide.
What is the SMILES notation for 4-(125I)iodo-N-prop-2-enyl(125I)benzamide?
The canonical SMILES for 4-(125I)iodo-N-prop-2-enyl(125I)benzamide is C=CCNC(=O)c1ccc([125I])cc1.
What is the InChIKey of 4-(125I)iodo-N-prop-2-enyl(125I)benzamide?
The InChIKey is DTRHPOUILNLLNZ-GQCOAOBCSA-N. The full InChI is InChI=1S/C10H10INO/c1-2-7-12-10(13)8-3-5-9(11)6-4-8/h2-6H,1,7H2,(H,12,13)/i11-2.
What are the key properties of 4-(125I)iodo-N-prop-2-enyl(125I)benzamide?
4-(125I)iodo-N-prop-2-enyl(125I)benzamide has a molecular weight of 285.10 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(125I)iodo-N-prop-2-enyl(125I)benzamide is sourced from PubChem (CID 118652264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).