N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide

C18H21NO2 — CID 107676610

IUPACN-(4-butylphenyl)-4-hydroxy-3-methylbenzamide
SMILESCCCCc1ccc(NC(=O)c2ccc(O)c(C)c2)cc1
InChIInChI=1S/C18H21NO2/c1-3-4-5-14-6-9-16(10-7-14)19-18(21)15-8-11-17(20)13(2)12-15/h6-12,20H,3-5H2,1-2H3,(H,19,21)
InChIKeyQUULYKPTYYPEQJ-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.30
Rot. Bonds5

About N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide

N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide (PubChem CID 107676610) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide.

Molecular Properties

Compound NameN-(4-butylphenyl)-4-hydroxy-3-methylbenzamide
PubChem CID107676610
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-(4-butylphenyl)-4-hydroxy-3-methylbenzamide
SMILESCCCCc1ccc(NC(=O)c2ccc(O)c(C)c2)cc1
InChIInChI=1S/C18H21NO2/c1-3-4-5-14-6-9-16(10-7-14)19-18(21)15-8-11-17(20)13(2)12-15/h6-12,20H,3-5H2,1-2H3,(H,19,21)
InChIKeyQUULYKPTYYPEQJ-UHFFFAOYSA-N
XLogP4.30
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-butylphenyl)-4-fluoro-3-sulfanylbenzamide
CID 107022704
4-butyl-N-(4-methylphenyl)benzamide;prop-1-ene
CID 142028227
N-(4-ethylphenyl)-4-pentylbenzamide
CID 142206594
N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide
CID 16651108
N-(4-butylphenyl)-2-methyl-1,3-dioxoisoindole-5-carboxamide
CID 26268853
N-[3-(3-aminopropyl)phenyl]-4-hydroxy-3-methylbenzamide
CID 107673369
3-bromo-4-methyl-N-(4-propylphenyl)benzamide
CID 81472098
4-butyl-N-(3,4-dichlorophenyl)benzamide
CID 3618565
4-butyl-2-methylphenol
CID 10964856
N-(4-butylphenyl)-2-fluoropyridine-4-carboxamide
CID 61294537
3,4-dihydroxy-N-[4-(2-hydroxyethyl)phenyl]benzamide
CID 103956147
N-(4-butylphenyl)-4-chloro-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide
CID 126416752

Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide?
The IUPAC name of N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide (CID 107676610) is N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide.
What is the SMILES notation for N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide?
The canonical SMILES for N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide is CCCCc1ccc(NC(=O)c2ccc(O)c(C)c2)cc1.
What is the InChIKey of N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide?
The InChIKey is QUULYKPTYYPEQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-3-4-5-14-6-9-16(10-7-14)19-18(21)15-8-11-17(20)13(2)12-15/h6-12,20H,3-5H2,1-2H3,(H,19,21).
What are the key properties of N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide?
N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide has a molecular weight of 283.37 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-(4-butylphenyl)-4-hydroxy-3-methylbenzamide is sourced from PubChem (CID 107676610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).