2-ethyl-4,5-dipropyl-1H-imidazole

C11H20N2 — CID 140833487

IUPAC2-ethyl-4,5-dipropyl-1H-imidazole
SMILESCCCc1nc(CC)[nH]c1CCC
InChIInChI=1S/C11H20N2/c1-4-7-9-10(8-5-2)13-11(6-3)12-9/h4-8H2,1-3H3,(H,12,13)
InChIKeyFRURSOPIVUOXPG-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.88
Rot. Bonds5

About 2-ethyl-4,5-dipropyl-1H-imidazole

2-ethyl-4,5-dipropyl-1H-imidazole (PubChem CID 140833487) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 2-ethyl-4,5-dipropyl-1H-imidazole.

Molecular Properties

Compound Name2-ethyl-4,5-dipropyl-1H-imidazole
PubChem CID140833487
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name2-ethyl-4,5-dipropyl-1H-imidazole
SMILESCCCc1nc(CC)[nH]c1CCC
InChIInChI=1S/C11H20N2/c1-4-7-9-10(8-5-2)13-11(6-3)12-9/h4-8H2,1-3H3,(H,12,13)
InChIKeyFRURSOPIVUOXPG-UHFFFAOYSA-N
XLogP2.88
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,5-dipropyl-1H-imidazole?
The IUPAC name of 2-ethyl-4,5-dipropyl-1H-imidazole (CID 140833487) is 2-ethyl-4,5-dipropyl-1H-imidazole.
What is the SMILES notation for 2-ethyl-4,5-dipropyl-1H-imidazole?
The canonical SMILES for 2-ethyl-4,5-dipropyl-1H-imidazole is CCCc1nc(CC)[nH]c1CCC.
What is the InChIKey of 2-ethyl-4,5-dipropyl-1H-imidazole?
The InChIKey is FRURSOPIVUOXPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-4-7-9-10(8-5-2)13-11(6-3)12-9/h4-8H2,1-3H3,(H,12,13).
What are the key properties of 2-ethyl-4,5-dipropyl-1H-imidazole?
2-ethyl-4,5-dipropyl-1H-imidazole has a molecular weight of 180.29 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,5-dipropyl-1H-imidazole is sourced from PubChem (CID 140833487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).