N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide

C23H23NO2 — CID 121085663

IUPACN-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCC(C)(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H23NO2/c1-17-8-6-7-11-21(17)22(25)24-16-23(2,26)20-14-12-19(13-15-20)18-9-4-3-5-10-18/h3-15,26H,16H2,1-2H3,(H,24,25)
InChIKeyVGWWDBHFTNOZQG-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.30
Rot. Bonds5

About N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide

N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide (PubChem CID 121085663) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide
PubChem CID121085663
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCC(C)(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H23NO2/c1-17-8-6-7-11-21(17)22(25)24-16-23(2,26)20-14-12-19(13-15-20)18-9-4-3-5-10-18/h3-15,26H,16H2,1-2H3,(H,24,25)
InChIKeyVGWWDBHFTNOZQG-UHFFFAOYSA-N
XLogP4.30
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-2-phenylpropyl)-2-methylbenzamide
CID 110663960
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2,5-dimethylfuran-3-carboxamide
CID 71781805
2,6-difluoro-N-[2-hydroxy-2-(4-phenylphenyl)propyl]benzamide
CID 71781812
N-(2-hydroxy-2-phenylpropyl)-4-methylbenzamide
CID 110663962
N-[(2S)-2-hydroxy-2-(4-phenylphenyl)propyl]-4-methoxybenzamide
CID 95982815
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 71781801
2-bromo-N-[(2S)-2-hydroxy-2-phenylpropyl]benzamide
CID 95368019
N-(2-hydroxy-2-methylpentyl)-2-methylbenzamide
CID 113240365
N-(2-hydroxy-2-methyl-4-phenylbutyl)-2-methylbenzamide
CID 90498445
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-1,2-oxazole-5-carboxamide
CID 90497502
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-1,3-benzothiazole-2-carboxamide
CID 90497526
N-(2-hydroxy-2-phenylpropyl)-2-oxo-1H-pyridine-3-carboxamide
CID 111335230

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide?
The IUPAC name of N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide (CID 121085663) is N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide.
What is the SMILES notation for N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide?
The canonical SMILES for N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide is Cc1ccccc1C(=O)NCC(C)(O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide?
The InChIKey is VGWWDBHFTNOZQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-17-8-6-7-11-21(17)22(25)24-16-23(2,26)20-14-12-19(13-15-20)18-9-4-3-5-10-18/h3-15,26H,16H2,1-2H3,(H,24,25).
What are the key properties of N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide?
N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide has a molecular weight of 345.44 g/mol, XLogP of 4.30, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-2-(4-phenylphenyl)propyl]-2-methylbenzamide is sourced from PubChem (CID 121085663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).