4-iodo-N-(2-phenylethyl)benzamide

C15H14INO — CID 1348743

IUPAC4-iodo-N-(2-phenylethyl)benzamide
SMILESO=C(NCCc1ccccc1)c1ccc(I)cc1
InChIInChI=1S/C15H14INO/c16-14-8-6-13(7-9-14)15(18)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,18)
InChIKeyFUXAEPHSVQCELP-UHFFFAOYSA-N
MW351.19 g/mol
LogP3.26
Rot. Bonds4

About 4-iodo-N-(2-phenylethyl)benzamide

4-iodo-N-(2-phenylethyl)benzamide (PubChem CID 1348743) has the molecular formula C15H14INO and a molecular weight of 351.19 g/mol. Its IUPAC name is 4-iodo-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound Name4-iodo-N-(2-phenylethyl)benzamide
PubChem CID1348743
Molecular FormulaC15H14INO
Molecular Weight351.19 g/mol
Exact Mass351.01
IUPAC Name4-iodo-N-(2-phenylethyl)benzamide
SMILESO=C(NCCc1ccccc1)c1ccc(I)cc1
InChIInChI=1S/C15H14INO/c16-14-8-6-13(7-9-14)15(18)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,18)
InChIKeyFUXAEPHSVQCELP-UHFFFAOYSA-N
XLogP3.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.19
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
4-ethyl-N-(2-phenylethyl)benzamide
CID 11841446
4-formyl-N-(2-phenylethyl)benzamide
CID 12773386
1-[4-(4-acetylphenyl)phenyl]ethanone;4-(4-acetylphenyl)-N-(2-phenylethyl)benzamide
CID 91489702
4-N-(2,6-difluorophenyl)-1-N-(2-phenylethyl)benzene-1,4-dicarboxamide
CID 109047887
1-methyl-N-(2-phenylethyl)pyridin-1-ium-3-carboxamide
CID 13473407
[difluoro-[4-(2-phenylethylcarbamoyl)phenyl]methyl]phosphonic acid
CID 46878793
N-(2-phenylethyl)-4-(3-phenylpropanoylamino)benzamide
CID 1296529
N-(2-phenylethyl)-4-(trifluoromethylsulfanyl)benzamide
CID 24654315
4-[2-[(3-iodobenzoyl)amino]ethyl]benzoic acid
CID 43233757
4-(2-methoxyethoxy)-N-(2-phenylethyl)benzamide
CID 15943281
4-(methylsulfamoyl)-N-(2-phenylethyl)benzamide
CID 51218673

Frequently Asked Questions

What is the IUPAC name of 4-iodo-N-(2-phenylethyl)benzamide?
The IUPAC name of 4-iodo-N-(2-phenylethyl)benzamide (CID 1348743) is 4-iodo-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 4-iodo-N-(2-phenylethyl)benzamide?
The canonical SMILES for 4-iodo-N-(2-phenylethyl)benzamide is O=C(NCCc1ccccc1)c1ccc(I)cc1.
What is the InChIKey of 4-iodo-N-(2-phenylethyl)benzamide?
The InChIKey is FUXAEPHSVQCELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14INO/c16-14-8-6-13(7-9-14)15(18)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,18).
What are the key properties of 4-iodo-N-(2-phenylethyl)benzamide?
4-iodo-N-(2-phenylethyl)benzamide has a molecular weight of 351.19 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodo-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 1348743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).