N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide

C16H16INO2 — CID 71145880

IUPACN-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(C)(O)c2ccc(I)cc2)cc1
InChIInChI=1S/C16H16INO2/c1-11(19)18-15-9-5-13(6-10-15)16(2,20)12-3-7-14(17)8-4-12/h3-10,20H,1-2H3,(H,18,19)
InChIKeyARTUTAPOGDEAEJ-UHFFFAOYSA-N
MW381.21 g/mol
LogP3.51
Rot. Bonds3

About N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide

N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide (PubChem CID 71145880) has the molecular formula C16H16INO2 and a molecular weight of 381.21 g/mol. Its IUPAC name is N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide
PubChem CID71145880
Molecular FormulaC16H16INO2
Molecular Weight381.21 g/mol
Exact Mass381.02
IUPAC NameN-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(C)(O)c2ccc(I)cc2)cc1
InChIInChI=1S/C16H16INO2/c1-11(19)18-15-9-5-13(6-10-15)16(2,20)12-3-7-14(17)8-4-12/h3-10,20H,1-2H3,(H,18,19)
InChIKeyARTUTAPOGDEAEJ-UHFFFAOYSA-N
XLogP3.51
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.21
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-iodophenyl)acetamide
CID 12147
N-(4-tert-butylphenyl)-N'-(4-iodophenyl)oxamide
CID 108529818
N-[4-(4-iodobenzoyl)phenyl]acetamide
CID 43337938
acetic acid;1-tert-butyl-4-iodobenzene
CID 172850232
4-iodo-N-[4-[(4-iodobenzoyl)amino]phenyl]benzamide
CID 4105689
molecular nitrogen;N-[4-(trifluoromethyl)phenyl]acetamide
CID 175275825
(4-acetamidophenyl) 4-iodobenzoate
CID 51152655
2-acetamido-N-(4-iodophenyl)acetamide
CID 60636455
2-acetamido-N-[2-(4-iodoanilino)-2-oxoethyl]acetamide
CID 60559925
N-[(4-acetamidophenyl)carbamoyl]-4-tert-butylbenzamide
CID 70307077
N-(4-acetamidophenyl)-2-(4-fluorophenyl)-2-methylpropanamide
CID 113197459
N-[4-[(2-hydroxy-2-phenylpropyl)amino]phenyl]acetamide
CID 62373656

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide?
The IUPAC name of N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide (CID 71145880) is N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide?
The canonical SMILES for N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide is CC(=O)Nc1ccc(C(C)(O)c2ccc(I)cc2)cc1.
What is the InChIKey of N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide?
The InChIKey is ARTUTAPOGDEAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16INO2/c1-11(19)18-15-9-5-13(6-10-15)16(2,20)12-3-7-14(17)8-4-12/h3-10,20H,1-2H3,(H,18,19).
What are the key properties of N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide?
N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide has a molecular weight of 381.21 g/mol, XLogP of 3.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-hydroxy-1-(4-iodophenyl)ethyl]phenyl]acetamide is sourced from PubChem (CID 71145880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).