N-(2-hydroxy-2-phenylethyl)tetradecanamide

C22H37NO2 — CID 71454780

IUPACN-(2-hydroxy-2-phenylethyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)NCC(O)c1ccccc1
InChIInChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-15-18-22(25)23-19-21(24)20-16-13-12-14-17-20/h12-14,16-17,21,24H,2-11,15,18-19H2,1H3,(H,23,25)
InChIKeyQGVDAFRQTLZCAZ-UHFFFAOYSA-N
MW347.54 g/mol
LogP5.54
Rot. Bonds15

About N-(2-hydroxy-2-phenylethyl)tetradecanamide

N-(2-hydroxy-2-phenylethyl)tetradecanamide (PubChem CID 71454780) has the molecular formula C22H37NO2 and a molecular weight of 347.54 g/mol. Its IUPAC name is N-(2-hydroxy-2-phenylethyl)tetradecanamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-phenylethyl)tetradecanamide
PubChem CID71454780
Molecular FormulaC22H37NO2
Molecular Weight347.54 g/mol
Exact Mass347.28
IUPAC NameN-(2-hydroxy-2-phenylethyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)NCC(O)c1ccccc1
InChIInChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-15-18-22(25)23-19-21(24)20-16-13-12-14-17-20/h12-14,16-17,21,24H,2-11,15,18-19H2,1H3,(H,23,25)
InChIKeyQGVDAFRQTLZCAZ-UHFFFAOYSA-N
XLogP5.54
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.54
LogP ≤ 55.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(2-hydroxy-2-phenylethyl)tetradecanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-phenylethyl)tetradecanamide?
The IUPAC name of N-(2-hydroxy-2-phenylethyl)tetradecanamide (CID 71454780) is N-(2-hydroxy-2-phenylethyl)tetradecanamide.
What is the SMILES notation for N-(2-hydroxy-2-phenylethyl)tetradecanamide?
The canonical SMILES for N-(2-hydroxy-2-phenylethyl)tetradecanamide is CCCCCCCCCCCCCC(=O)NCC(O)c1ccccc1.
What is the InChIKey of N-(2-hydroxy-2-phenylethyl)tetradecanamide?
The InChIKey is QGVDAFRQTLZCAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-15-18-22(25)23-19-21(24)20-16-13-12-14-17-20/h12-14,16-17,21,24H,2-11,15,18-19H2,1H3,(H,23,25).
What are the key properties of N-(2-hydroxy-2-phenylethyl)tetradecanamide?
N-(2-hydroxy-2-phenylethyl)tetradecanamide has a molecular weight of 347.54 g/mol, XLogP of 5.54, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-phenylethyl)tetradecanamide is sourced from PubChem (CID 71454780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).