N-(3-butyl-4-hydroxyphenyl)tetradecanamide

C24H41NO2 — CID 142641305

IUPACN-(3-butyl-4-hydroxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccc(O)c(CCCC)c1
InChIInChI=1S/C24H41NO2/c1-3-5-7-8-9-10-11-12-13-14-15-17-24(27)25-22-18-19-23(26)21(20-22)16-6-4-2/h18-20,26H,3-17H2,1-2H3,(H,25,27)
InChIKeyZGGZVVRLHMHOFF-UHFFFAOYSA-N
MW375.60 g/mol
LogP7.37
Rot. Bonds16

About N-(3-butyl-4-hydroxyphenyl)tetradecanamide

N-(3-butyl-4-hydroxyphenyl)tetradecanamide (PubChem CID 142641305) has the molecular formula C24H41NO2 and a molecular weight of 375.60 g/mol. Its IUPAC name is N-(3-butyl-4-hydroxyphenyl)tetradecanamide.

Molecular Properties

Compound NameN-(3-butyl-4-hydroxyphenyl)tetradecanamide
PubChem CID142641305
Molecular FormulaC24H41NO2
Molecular Weight375.60 g/mol
Exact Mass375.31
IUPAC NameN-(3-butyl-4-hydroxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccc(O)c(CCCC)c1
InChIInChI=1S/C24H41NO2/c1-3-5-7-8-9-10-11-12-13-14-15-17-24(27)25-22-18-19-23(26)21(20-22)16-6-4-2/h18-20,26H,3-17H2,1-2H3,(H,25,27)
InChIKeyZGGZVVRLHMHOFF-UHFFFAOYSA-N
XLogP7.37
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.60
LogP ≤ 57.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze N-(3-butyl-4-hydroxyphenyl)tetradecanamide 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-hydroxy-3-methylphenyl)tetradecanamide
CID 91054297
N-(3-fluoro-4-hydroxyphenyl)decanamide
CID 65426538
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N-(3,4-dimethylphenyl)dodecanamide
CID 4067786
N-(3-tert-butyl-4-hydroxyphenyl)octadecanamide
CID 21290134
N-(3-tert-butyl-4-hydroxyphenyl)nonanamide
CID 21290138
2-butyl-4-(methylamino)phenol
CID 154275387
N-(3-hydroxyphenyl)nonadecanamide
CID 19039287
N-(4-hydroxyphenyl)-6-(2-octadecanoylhydrazinyl)-6-oxohexanamide
CID 139759322
N-(4-heptylphenyl)heptanamide
CID 101077737
11-[2-(3-butyl-4-hydroxy-5-methylanilino)-2-oxoethyl]sulfanyl-N-(3-butyl-4-hydroxy-5-methylphenyl)undecanamide
CID 21421482
3-[4-(octanoylamino)phenyl]propanoic acid
CID 81370098

Frequently Asked Questions

What is the IUPAC name of N-(3-butyl-4-hydroxyphenyl)tetradecanamide?
The IUPAC name of N-(3-butyl-4-hydroxyphenyl)tetradecanamide (CID 142641305) is N-(3-butyl-4-hydroxyphenyl)tetradecanamide.
What is the SMILES notation for N-(3-butyl-4-hydroxyphenyl)tetradecanamide?
The canonical SMILES for N-(3-butyl-4-hydroxyphenyl)tetradecanamide is CCCCCCCCCCCCCC(=O)Nc1ccc(O)c(CCCC)c1.
What is the InChIKey of N-(3-butyl-4-hydroxyphenyl)tetradecanamide?
The InChIKey is ZGGZVVRLHMHOFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO2/c1-3-5-7-8-9-10-11-12-13-14-15-17-24(27)25-22-18-19-23(26)21(20-22)16-6-4-2/h18-20,26H,3-17H2,1-2H3,(H,25,27).
What are the key properties of N-(3-butyl-4-hydroxyphenyl)tetradecanamide?
N-(3-butyl-4-hydroxyphenyl)tetradecanamide has a molecular weight of 375.60 g/mol, XLogP of 7.37, 16 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butyl-4-hydroxyphenyl)tetradecanamide is sourced from PubChem (CID 142641305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).