3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide

C15H14INO2 — CID 29404443

IUPAC3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide
SMILESO=C(CCc1ccccc1O)Nc1ccc(I)cc1
InChIInChI=1S/C15H14INO2/c16-12-6-8-13(9-7-12)17-15(19)10-5-11-3-1-2-4-14(11)18/h1-4,6-9,18H,5,10H2,(H,17,19)
InChIKeyQXXGOBOZHQZADB-UHFFFAOYSA-N
MW367.19 g/mol
LogP3.57
Rot. Bonds4

About 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide

3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide (PubChem CID 29404443) has the molecular formula C15H14INO2 and a molecular weight of 367.19 g/mol. Its IUPAC name is 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide.

Molecular Properties

Compound Name3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide
PubChem CID29404443
Molecular FormulaC15H14INO2
Molecular Weight367.19 g/mol
Exact Mass367.01
IUPAC Name3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide
SMILESO=C(CCc1ccccc1O)Nc1ccc(I)cc1
InChIInChI=1S/C15H14INO2/c16-12-6-8-13(9-7-12)17-15(19)10-5-11-3-1-2-4-14(11)18/h1-4,6-9,18H,5,10H2,(H,17,19)
InChIKeyQXXGOBOZHQZADB-UHFFFAOYSA-N
XLogP3.57
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.19
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide?
The IUPAC name of 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide (CID 29404443) is 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide.
What is the SMILES notation for 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide?
The canonical SMILES for 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide is O=C(CCc1ccccc1O)Nc1ccc(I)cc1.
What is the InChIKey of 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide?
The InChIKey is QXXGOBOZHQZADB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14INO2/c16-12-6-8-13(9-7-12)17-15(19)10-5-11-3-1-2-4-14(11)18/h1-4,6-9,18H,5,10H2,(H,17,19).
What are the key properties of 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide?
3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide has a molecular weight of 367.19 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyphenyl)-N-(4-iodophenyl)propanamide is sourced from PubChem (CID 29404443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).