8-hydroxy-N-(2-phenylethyl)pentadecanamide

C23H39NO2 — CID 11726119

IUPAC8-hydroxy-N-(2-phenylethyl)pentadecanamide
SMILESCCCCCCCC(O)CCCCCCC(=O)NCCc1ccccc1
InChIInChI=1S/C23H39NO2/c1-2-3-4-5-11-16-22(25)17-12-6-7-13-18-23(26)24-20-19-21-14-9-8-10-15-21/h8-10,14-15,22,25H,2-7,11-13,16-20H2,1H3,(H,24,26)
InChIKeyJJZSGRYZZBAVAB-UHFFFAOYSA-N
MW361.57 g/mol
LogP5.41
Rot. Bonds16

About 8-hydroxy-N-(2-phenylethyl)pentadecanamide

8-hydroxy-N-(2-phenylethyl)pentadecanamide (PubChem CID 11726119) has the molecular formula C23H39NO2 and a molecular weight of 361.57 g/mol. Its IUPAC name is 8-hydroxy-N-(2-phenylethyl)pentadecanamide.

Molecular Properties

Compound Name8-hydroxy-N-(2-phenylethyl)pentadecanamide
PubChem CID11726119
Molecular FormulaC23H39NO2
Molecular Weight361.57 g/mol
Exact Mass361.30
IUPAC Name8-hydroxy-N-(2-phenylethyl)pentadecanamide
SMILESCCCCCCCC(O)CCCCCCC(=O)NCCc1ccccc1
InChIInChI=1S/C23H39NO2/c1-2-3-4-5-11-16-22(25)17-12-6-7-13-18-23(26)24-20-19-21-14-9-8-10-15-21/h8-10,14-15,22,25H,2-7,11-13,16-20H2,1H3,(H,24,26)
InChIKeyJJZSGRYZZBAVAB-UHFFFAOYSA-N
XLogP5.41
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.57
LogP ≤ 55.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-N-(2-phenylethyl)pentadecanamide?
The IUPAC name of 8-hydroxy-N-(2-phenylethyl)pentadecanamide (CID 11726119) is 8-hydroxy-N-(2-phenylethyl)pentadecanamide.
What is the SMILES notation for 8-hydroxy-N-(2-phenylethyl)pentadecanamide?
The canonical SMILES for 8-hydroxy-N-(2-phenylethyl)pentadecanamide is CCCCCCCC(O)CCCCCCC(=O)NCCc1ccccc1.
What is the InChIKey of 8-hydroxy-N-(2-phenylethyl)pentadecanamide?
The InChIKey is JJZSGRYZZBAVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H39NO2/c1-2-3-4-5-11-16-22(25)17-12-6-7-13-18-23(26)24-20-19-21-14-9-8-10-15-21/h8-10,14-15,22,25H,2-7,11-13,16-20H2,1H3,(H,24,26).
What are the key properties of 8-hydroxy-N-(2-phenylethyl)pentadecanamide?
8-hydroxy-N-(2-phenylethyl)pentadecanamide has a molecular weight of 361.57 g/mol, XLogP of 5.41, 16 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-N-(2-phenylethyl)pentadecanamide is sourced from PubChem (CID 11726119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).