2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide

C14H21NO3 — CID 113348236

IUPAC2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide
SMILESCC(C)(CCCO)CNC(=O)c1ccccc1O
InChIInChI=1S/C14H21NO3/c1-14(2,8-5-9-16)10-15-13(18)11-6-3-4-7-12(11)17/h3-4,6-7,16-17H,5,8-10H2,1-2H3,(H,15,18)
InChIKeyBZTWRJXJKLTYAA-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.92
Rot. Bonds6

About 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide

2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide (PubChem CID 113348236) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide
PubChem CID113348236
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide
SMILESCC(C)(CCCO)CNC(=O)c1ccccc1O
InChIInChI=1S/C14H21NO3/c1-14(2,8-5-9-16)10-15-13(18)11-6-3-4-7-12(11)17/h3-4,6-7,16-17H,5,8-10H2,1-2H3,(H,15,18)
InChIKeyBZTWRJXJKLTYAA-UHFFFAOYSA-N
XLogP1.92
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)-2-methylbenzamide
CID 103899701
N-(5-hydroxy-2,2-dimethylpentyl)naphthalene-1-carboxamide
CID 103899589
N-(2,2-dimethylbutyl)-2-hydroxybenzamide
CID 103461996
N-(5-hydroxy-2,2-dimethylpentyl)-2-(2-hydroxyphenyl)acetamide
CID 103901151
2-fluoro-6-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide
CID 104920591
N-(5-hydroxy-2,2-dimethylpentyl)-2-oxo-1H-pyridine-3-carboxamide
CID 103900087
2-chloro-5-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide
CID 106141392
N-(5-chloro-2,2-dimethylpentyl)-3-hydroxy-2-methylbenzamide
CID 106144803
4-chloro-N-(5-hydroxy-2,2-dimethylpentyl)-2-methylbenzamide
CID 103899859
2-bromo-5-chloro-N-(5-hydroxy-2,2-dimethylpentyl)benzamide
CID 103899354
5-amino-N-(5-hydroxy-2,2-dimethylpentyl)-2-methylbenzamide
CID 106139408
N-[2,2-dimethyl-3-(2-phenylphenyl)propyl]-2-hydroxybenzamide
CID 118471963

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide?
The IUPAC name of 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide (CID 113348236) is 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide.
What is the SMILES notation for 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide?
The canonical SMILES for 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide is CC(C)(CCCO)CNC(=O)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide?
The InChIKey is BZTWRJXJKLTYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-14(2,8-5-9-16)10-15-13(18)11-6-3-4-7-12(11)17/h3-4,6-7,16-17H,5,8-10H2,1-2H3,(H,15,18).
What are the key properties of 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide?
2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide has a molecular weight of 251.33 g/mol, XLogP of 1.92, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(5-hydroxy-2,2-dimethylpentyl)benzamide is sourced from PubChem (CID 113348236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).