N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide

C15H14INO2 — CID 103772803

IUPACN-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide
SMILESO=C(N[C@@H](CO)c1ccccc1)c1ccccc1I
InChIInChI=1S/C15H14INO2/c16-13-9-5-4-8-12(13)15(19)17-14(10-18)11-6-2-1-3-7-11/h1-9,14,18H,10H2,(H,17,19)/t14-/m0/s1
InChIKeyRDLRFNGNCTUYAQ-AWEZNQCLSA-N
MW367.19 g/mol
LogP2.75
Rot. Bonds4

About N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide

N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide (PubChem CID 103772803) has the molecular formula C15H14INO2 and a molecular weight of 367.19 g/mol. Its IUPAC name is N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide.

Molecular Properties

Compound NameN-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide
PubChem CID103772803
Molecular FormulaC15H14INO2
Molecular Weight367.19 g/mol
Exact Mass367.01
IUPAC NameN-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide
SMILESO=C(N[C@@H](CO)c1ccccc1)c1ccccc1I
InChIInChI=1S/C15H14INO2/c16-13-9-5-4-8-12(13)15(19)17-14(10-18)11-6-2-1-3-7-11/h1-9,14,18H,10H2,(H,17,19)/t14-/m0/s1
InChIKeyRDLRFNGNCTUYAQ-AWEZNQCLSA-N
XLogP2.75
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 ≤ 52.75
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

2-chloro-N-[(1R)-2-hydroxy-1-phenylethyl]benzamide
CID 39374837
2-fluoro-N-(2-hydroxy-1-phenylethyl)benzamide
CID 3315693
N-[(1S)-2-hydroxy-1-phenylethyl]-2,3,5-triiodobenzamide
CID 107863447
N-[(1S)-2-hydroxy-1-phenylethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 103945014
N-(1,3-dihydroxypropan-2-yl)-2-iodobenzamide
CID 65312404
N-benzhydryl-2-iodobenzamide
CID 2255693
2-hydroxy-N-[(1S)-2-hydroxy-1-phenylethyl]-5-iodobenzamide
CID 103526856
N-(2-hydroxy-1-phenylethyl)benzamide
CID 14150746
3-amino-2-hydroxy-N-[(1S)-2-hydroxy-1-phenylethyl]benzamide
CID 58736733
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide
CID 39370043
N-[(1R)-2-hydroxy-1-phenylethyl]-2-(trifluoromethyl)benzamide
CID 40548744
N-[(1S)-2-hydroxy-1-phenylethyl]-1H-indole-7-carboxamide
CID 103945364

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide?
The IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide (CID 103772803) is N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide.
What is the SMILES notation for N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide?
The canonical SMILES for N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide is O=C(N[C@@H](CO)c1ccccc1)c1ccccc1I.
What is the InChIKey of N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide?
The InChIKey is RDLRFNGNCTUYAQ-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H14INO2/c16-13-9-5-4-8-12(13)15(19)17-14(10-18)11-6-2-1-3-7-11/h1-9,14,18H,10H2,(H,17,19)/t14-/m0/s1.
What are the key properties of N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide?
N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide has a molecular weight of 367.19 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-hydroxy-1-phenylethyl]-2-iodobenzamide is sourced from PubChem (CID 103772803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).