N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide

C24H25NO2 — CID 118471963

IUPACN-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide
SMILESCC(C)(CNC(=O)c1ccccc1O)Cc1ccccc1-c1ccccc1
InChIInChI=1S/C24H25NO2/c1-24(2,17-25-23(27)21-14-8-9-15-22(21)26)16-19-12-6-7-13-20(19)18-10-4-3-5-11-18/h3-15,26H,16-17H2,1-2H3,(H,25,27)
InChIKeyLQWNRGUSEBBTIT-UHFFFAOYSA-N
MW359.47 g/mol
LogP5.06
Rot. Bonds6

About N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide

N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide (PubChem CID 118471963) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide
PubChem CID118471963
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide
SMILESCC(C)(CNC(=O)c1ccccc1O)Cc1ccccc1-c1ccccc1
InChIInChI=1S/C24H25NO2/c1-24(2,17-25-23(27)21-14-8-9-15-22(21)26)16-19-12-6-7-13-20(19)18-10-4-3-5-11-18/h3-15,26H,16-17H2,1-2H3,(H,25,27)
InChIKeyLQWNRGUSEBBTIT-UHFFFAOYSA-N
XLogP5.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 55.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-dimethylbutyl)-2-hydroxybenzamide
CID 103461996
2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide
CID 113348236
N-[3-[5-chloro-2-(2H-tetrazol-5-yl)phenyl]-2,2-dimethylpropyl]-2-hydroxybenzamide
CID 90185417
3-[(2-ethylbenzoyl)amino]-2-methyl-2-phenylpropanoic acid
CID 120701661
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-2-hydroxybenzamide
CID 103824551
2-(2-aminoethyl)-N-(3-hydroxy-2,2-dimethylpropyl)benzamide
CID 113293967
N-(4-hydroxy-2,2-dimethylbutyl)-2-[2-(methylamino)ethyl]benzamide
CID 106147962
N-(4-hydroxy-2,2-dimethylbutyl)-2-(2-hydroxyphenyl)acetamide
CID 103772553
2-bromo-3-fluoro-N-(3-hydroxy-2,2-dimethylpropyl)benzamide
CID 115360486
N-(3-amino-2,2-difluoropropyl)-2-hydroxybenzamide
CID 114383534
3-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)-2-methylbenzamide
CID 103899701
2-fluoro-6-hydroxy-N-(3-hydroxy-2,2-dimethylpropyl)benzamide
CID 100615294

Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide?
The IUPAC name of N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide (CID 118471963) is N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide.
What is the SMILES notation for N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide?
The canonical SMILES for N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide is CC(C)(CNC(=O)c1ccccc1O)Cc1ccccc1-c1ccccc1.
What is the InChIKey of N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide?
The InChIKey is LQWNRGUSEBBTIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-24(2,17-25-23(27)21-14-8-9-15-22(21)26)16-19-12-6-7-13-20(19)18-10-4-3-5-11-18/h3-15,26H,16-17H2,1-2H3,(H,25,27).
What are the key properties of N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide?
N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide has a molecular weight of 359.47 g/mol, XLogP of 5.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide is sourced from PubChem (CID 118471963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).