N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide

C22H34N2O2 — CID 24749271

IUPACN-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide
SMILESCCCCCCCCCCCC(=O)NCCc1c[nH]c2ccc(O)cc12
InChIInChI=1S/C22H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-22(26)23-15-14-18-17-24-21-13-12-19(25)16-20(18)21/h12-13,16-17,24-25H,2-11,14-15H2,1H3,(H,23,26)
InChIKeyMOQBGJJXYJJJFQ-UHFFFAOYSA-N
MW358.53 g/mol
LogP5.45
Rot. Bonds13

About N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide

N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide (PubChem CID 24749271) has the molecular formula C22H34N2O2 and a molecular weight of 358.53 g/mol. Its IUPAC name is N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide.

Molecular Properties

Compound NameN-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide
PubChem CID24749271
Molecular FormulaC22H34N2O2
Molecular Weight358.53 g/mol
Exact Mass358.26
IUPAC NameN-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide
SMILESCCCCCCCCCCCC(=O)NCCc1c[nH]c2ccc(O)cc12
InChIInChI=1S/C22H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-22(26)23-15-14-18-17-24-21-13-12-19(25)16-20(18)21/h12-13,16-17,24-25H,2-11,14-15H2,1H3,(H,23,26)
InChIKeyMOQBGJJXYJJJFQ-UHFFFAOYSA-N
XLogP5.45
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.53
LogP ≤ 55.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide 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-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide?
The IUPAC name of N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide (CID 24749271) is N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide.
What is the SMILES notation for N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide?
The canonical SMILES for N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide is CCCCCCCCCCCC(=O)NCCc1c[nH]c2ccc(O)cc12.
What is the InChIKey of N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide?
The InChIKey is MOQBGJJXYJJJFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-22(26)23-15-14-18-17-24-21-13-12-19(25)16-20(18)21/h12-13,16-17,24-25H,2-11,14-15H2,1H3,(H,23,26).
What are the key properties of N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide?
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide has a molecular weight of 358.53 g/mol, XLogP of 5.45, 13 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]dodecanamide is sourced from PubChem (CID 24749271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).