4-butyl-1,5-dipropylimidazole

C13H24N2 — CID 11769714

IUPAC4-butyl-1,5-dipropylimidazole
SMILESCCCCc1ncn(CCC)c1CCC
InChIInChI=1S/C13H24N2/c1-4-7-9-12-13(8-5-2)15(10-6-3)11-14-12/h11H,4-10H2,1-3H3
InChIKeyQJCBCGVSUHWEOD-UHFFFAOYSA-N
MW208.35 g/mol
LogP3.59
Rot. Bonds7

About 4-butyl-1,5-dipropylimidazole

4-butyl-1,5-dipropylimidazole (PubChem CID 11769714) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 4-butyl-1,5-dipropylimidazole.

Molecular Properties

Compound Name4-butyl-1,5-dipropylimidazole
PubChem CID11769714
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name4-butyl-1,5-dipropylimidazole
SMILESCCCCc1ncn(CCC)c1CCC
InChIInChI=1S/C13H24N2/c1-4-7-9-12-13(8-5-2)15(10-6-3)11-14-12/h11H,4-10H2,1-3H3
InChIKeyQJCBCGVSUHWEOD-UHFFFAOYSA-N
XLogP3.59
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-1,5-dipropylimidazole?
The IUPAC name of 4-butyl-1,5-dipropylimidazole (CID 11769714) is 4-butyl-1,5-dipropylimidazole.
What is the SMILES notation for 4-butyl-1,5-dipropylimidazole?
The canonical SMILES for 4-butyl-1,5-dipropylimidazole is CCCCc1ncn(CCC)c1CCC.
What is the InChIKey of 4-butyl-1,5-dipropylimidazole?
The InChIKey is QJCBCGVSUHWEOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-4-7-9-12-13(8-5-2)15(10-6-3)11-14-12/h11H,4-10H2,1-3H3.
What are the key properties of 4-butyl-1,5-dipropylimidazole?
4-butyl-1,5-dipropylimidazole has a molecular weight of 208.35 g/mol, XLogP of 3.59, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-1,5-dipropylimidazole is sourced from PubChem (CID 11769714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).