5-butyl-1-propyl-4,5-dihydroimidazole

C10H20N2 — CID 57079769

IUPAC5-butyl-1-propyl-4,5-dihydroimidazole
SMILESCCCCC1CN=CN1CCC
InChIInChI=1S/C10H20N2/c1-3-5-6-10-8-11-9-12(10)7-4-2/h9-10H,3-8H2,1-2H3
InChIKeyGUDFLHFXIAQSIA-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.30
Rot. Bonds5

About 5-butyl-1-propyl-4,5-dihydroimidazole

5-butyl-1-propyl-4,5-dihydroimidazole (PubChem CID 57079769) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 5-butyl-1-propyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name5-butyl-1-propyl-4,5-dihydroimidazole
PubChem CID57079769
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name5-butyl-1-propyl-4,5-dihydroimidazole
SMILESCCCCC1CN=CN1CCC
InChIInChI=1S/C10H20N2/c1-3-5-6-10-8-11-9-12(10)7-4-2/h9-10H,3-8H2,1-2H3
InChIKeyGUDFLHFXIAQSIA-UHFFFAOYSA-N
XLogP2.30
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-1-methyl-4,5-dihydroimidazole
CID 54162851
2-butyl-1-pentyl-3-propyl-2H-imidazole
CID 69393586
1,5-dipentyl-4,5-dihydrotriazole
CID 67937097
3-tert-butyl-2-hexyl-4-propyl-3H-1,2,4-triazole
CID 69387527
2-hexyl-1-octadecyl-3-propyl-2H-imidazole
CID 69390514
2-pentadecyl-1-propyl-3-tridecyl-2H-imidazole
CID 69391434
2-hexyl-1-nonadecyl-3-propyl-2H-imidazole
CID 69390950
1-pentyl-3-propyl-2-tridecyl-2H-imidazole
CID 69386489
2-dodecyl-1-hexyl-3-propyl-2H-imidazole
CID 69389075
1-octadecyl-2,3-dipropyl-2H-imidazole
CID 69386966
1-propyl-2,3-di(tridecyl)-2H-imidazole
CID 69395493
2-heptyl-1-propyl-3-undecyl-2H-imidazole
CID 69389082

Frequently Asked Questions

What is the IUPAC name of 5-butyl-1-propyl-4,5-dihydroimidazole?
The IUPAC name of 5-butyl-1-propyl-4,5-dihydroimidazole (CID 57079769) is 5-butyl-1-propyl-4,5-dihydroimidazole.
What is the SMILES notation for 5-butyl-1-propyl-4,5-dihydroimidazole?
The canonical SMILES for 5-butyl-1-propyl-4,5-dihydroimidazole is CCCCC1CN=CN1CCC.
What is the InChIKey of 5-butyl-1-propyl-4,5-dihydroimidazole?
The InChIKey is GUDFLHFXIAQSIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-5-6-10-8-11-9-12(10)7-4-2/h9-10H,3-8H2,1-2H3.
What are the key properties of 5-butyl-1-propyl-4,5-dihydroimidazole?
5-butyl-1-propyl-4,5-dihydroimidazole has a molecular weight of 168.28 g/mol, XLogP of 2.30, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-1-propyl-4,5-dihydroimidazole is sourced from PubChem (CID 57079769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).