1-tricos-8-en-7-yl-4,5-dihydroimidazole

C26H50N2 — CID 69115156

IUPAC1-tricos-8-en-7-yl-4,5-dihydroimidazole
SMILESCCCCCCCCCCCCCCC=CC(CCCCCC)N1C=NCC1
InChIInChI=1S/C26H50N2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-22-26(21-19-8-6-4-2)28-24-23-27-25-28/h20,22,25-26H,3-19,21,23-24H2,1-2H3
InChIKeyKJEHPKGNPJDFAM-UHFFFAOYSA-N
MW390.70 g/mol
LogP8.32
Rot. Bonds20

About 1-tricos-8-en-7-yl-4,5-dihydroimidazole

1-tricos-8-en-7-yl-4,5-dihydroimidazole (PubChem CID 69115156) has the molecular formula C26H50N2 and a molecular weight of 390.70 g/mol. Its IUPAC name is 1-tricos-8-en-7-yl-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-tricos-8-en-7-yl-4,5-dihydroimidazole
PubChem CID69115156
Molecular FormulaC26H50N2
Molecular Weight390.70 g/mol
Exact Mass390.40
IUPAC Name1-tricos-8-en-7-yl-4,5-dihydroimidazole
SMILESCCCCCCCCCCCCCCC=CC(CCCCCC)N1C=NCC1
InChIInChI=1S/C26H50N2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-22-26(21-19-8-6-4-2)28-24-23-27-25-28/h20,22,25-26H,3-19,21,23-24H2,1-2H3
InChIKeyKJEHPKGNPJDFAM-UHFFFAOYSA-N
XLogP8.32
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds20
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.70
LogP ≤ 58.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-tricos-8-en-7-yl-4,5-dihydroimidazole 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

1-icos-5-en-4-yl-4,5-dihydroimidazole;prop-2-enoic acid
CID 69115000
azane;1-nonadec-4-en-2-yl-4,5-dihydroimidazole
CID 174771585
1-(4,5-dihydroimidazol-1-yl)nonadecan-1-ol
CID 57204526
2-(4,5-dihydroimidazol-1-yl)nonan-1-ol
CID 174900137
3-(4,5-dihydroimidazol-1-yl)nonadecan-2-ol
CID 70378398
3-(4,5-dihydroimidazol-1-ylamino)nonadec-4-en-1-ol
CID 70536122
1-[(Z)-icos-9-enyl]-4,5-dihydroimidazole
CID 141148808
1-(4,5-dihydroimidazol-1-yl)pentan-1-amine
CID 70539508
(Z)-1-N'-[2-(4,5-dihydroimidazol-1-yl)ethyl]icos-11-ene-1,1-diamine
CID 70406814
N-[(Z)-octadec-9-enyl]-4,5-dihydroimidazol-1-amine
CID 67857827
3-(4,5-dihydroimidazol-1-yl)-N-ethyl-N-heptadecylicosan-1-amine
CID 70611322
9,10-dioctyloctadeca-7,11-diene
CID 173120989

Frequently Asked Questions

What is the IUPAC name of 1-tricos-8-en-7-yl-4,5-dihydroimidazole?
The IUPAC name of 1-tricos-8-en-7-yl-4,5-dihydroimidazole (CID 69115156) is 1-tricos-8-en-7-yl-4,5-dihydroimidazole.
What is the SMILES notation for 1-tricos-8-en-7-yl-4,5-dihydroimidazole?
The canonical SMILES for 1-tricos-8-en-7-yl-4,5-dihydroimidazole is CCCCCCCCCCCCCCC=CC(CCCCCC)N1C=NCC1.
What is the InChIKey of 1-tricos-8-en-7-yl-4,5-dihydroimidazole?
The InChIKey is KJEHPKGNPJDFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50N2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-22-26(21-19-8-6-4-2)28-24-23-27-25-28/h20,22,25-26H,3-19,21,23-24H2,1-2H3.
What are the key properties of 1-tricos-8-en-7-yl-4,5-dihydroimidazole?
1-tricos-8-en-7-yl-4,5-dihydroimidazole has a molecular weight of 390.70 g/mol, XLogP of 8.32, 20 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tricos-8-en-7-yl-4,5-dihydroimidazole is sourced from PubChem (CID 69115156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).