2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol

C23H46N2O — CID 19376922

IUPAC2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol
SMILESCCCCCCCCCCCCCCCCCCC1=NCC(CCO)N1
InChIInChI=1S/C23H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-24-21-22(25-23)19-20-26/h22,26H,2-21H2,1H3,(H,24,25)
InChIKeyXZGXBSJEWKSUDK-UHFFFAOYSA-N
MW366.63 g/mol
LogP6.39
Rot. Bonds19

About 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol

2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol (PubChem CID 19376922) has the molecular formula C23H46N2O and a molecular weight of 366.63 g/mol. Its IUPAC name is 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol.

Molecular Properties

Compound Name2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol
PubChem CID19376922
Molecular FormulaC23H46N2O
Molecular Weight366.63 g/mol
Exact Mass366.36
IUPAC Name2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol
SMILESCCCCCCCCCCCCCCCCCCC1=NCC(CCO)N1
InChIInChI=1S/C23H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-24-21-22(25-23)19-20-26/h22,26H,2-21H2,1H3,(H,24,25)
InChIKeyXZGXBSJEWKSUDK-UHFFFAOYSA-N
XLogP6.39
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.63
LogP ≤ 56.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol 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

2-(2-nonyl-4,5-dihydro-1H-imidazol-5-yl)ethanol
CID 123914747
5-(2-dodecyl-4,5-dihydro-1H-imidazol-5-yl)pentan-1-ol
CID 70187734
2,5-dibutyl-4,5-dihydro-1H-imidazole
CID 88688688
2-[5-[(Z)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-2-yl]ethanol
CID 66623851
2-[5-(2-dodecylcyclohexyl)-4,5-dihydro-1H-imidazol-2-yl]ethanol
CID 70536806
2-(2-propan-2-yl-4,5-dihydro-1H-imidazol-5-yl)ethanol;dihydrochloride
CID 66718047
2-non-8-enyl-5-prop-2-enyl-4,5-dihydro-1H-imidazole
CID 69133066
1,2-diheptylcyclopropene
CID 557048
2-(3-methyl-2-undecyl-4,5-dihydro-1H-imidazol-3-ium-4-yl)ethanol chloride
CID 67885409
(2S,5R)-2-hexyl-5-nonylpyrrolidine
CID 163001890
1-butyl-2-hexylcyclopropene
CID 134897823
2,5-dimethyl-4,5-dihydro-1H-imidazole;2-undecyl-4,5-dihydro-1H-imidazole
CID 159869190

Frequently Asked Questions

What is the IUPAC name of 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol?
The IUPAC name of 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol (CID 19376922) is 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol.
What is the SMILES notation for 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol?
The canonical SMILES for 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol is CCCCCCCCCCCCCCCCCCC1=NCC(CCO)N1.
What is the InChIKey of 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol?
The InChIKey is XZGXBSJEWKSUDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-24-21-22(25-23)19-20-26/h22,26H,2-21H2,1H3,(H,24,25).
What are the key properties of 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol?
2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol has a molecular weight of 366.63 g/mol, XLogP of 6.39, 19 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-octadecyl-4,5-dihydro-1H-imidazol-5-yl)ethanol is sourced from PubChem (CID 19376922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).