1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole

C15H24N4 — CID 20669177

IUPAC1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole
SMILESCc1cnc(C)n1CCCCCn1c(C)cnc1C
InChIInChI=1S/C15H24N4/c1-12-10-16-14(3)18(12)8-6-5-7-9-19-13(2)11-17-15(19)4/h10-11H,5-9H2,1-4H3
InChIKeySNWQMRBZWVJXFW-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.18
Rot. Bonds6

About 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole

1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole (PubChem CID 20669177) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole.

Molecular Properties

Compound Name1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole
PubChem CID20669177
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole
SMILESCc1cnc(C)n1CCCCCn1c(C)cnc1C
InChIInChI=1S/C15H24N4/c1-12-10-16-14(3)18(12)8-6-5-7-9-19-13(2)11-17-15(19)4/h10-11H,5-9H2,1-4H3
InChIKeySNWQMRBZWVJXFW-UHFFFAOYSA-N
XLogP3.18
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole?
The IUPAC name of 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole (CID 20669177) is 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole.
What is the SMILES notation for 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole?
The canonical SMILES for 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole is Cc1cnc(C)n1CCCCCn1c(C)cnc1C.
What is the InChIKey of 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole?
The InChIKey is SNWQMRBZWVJXFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-12-10-16-14(3)18(12)8-6-5-7-9-19-13(2)11-17-15(19)4/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole?
1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole has a molecular weight of 260.38 g/mol, XLogP of 3.18, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,5-dimethylimidazol-1-yl)pentyl]-2,5-dimethylimidazole is sourced from PubChem (CID 20669177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).