1,4-diethyl-2,3,5-trimethyl-2H-imidazole

C10H20N2 — CID 70020663

IUPAC1,4-diethyl-2,3,5-trimethyl-2H-imidazole
SMILESCCC1=C(C)N(CC)C(C)N1C
InChIInChI=1S/C10H20N2/c1-6-10-8(3)12(7-2)9(4)11(10)5/h9H,6-7H2,1-5H3
InChIKeyNQJFTXGPROINFI-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.24
Rot. Bonds2

About 1,4-diethyl-2,3,5-trimethyl-2H-imidazole

1,4-diethyl-2,3,5-trimethyl-2H-imidazole (PubChem CID 70020663) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1,4-diethyl-2,3,5-trimethyl-2H-imidazole.

Molecular Properties

Compound Name1,4-diethyl-2,3,5-trimethyl-2H-imidazole
PubChem CID70020663
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1,4-diethyl-2,3,5-trimethyl-2H-imidazole
SMILESCCC1=C(C)N(CC)C(C)N1C
InChIInChI=1S/C10H20N2/c1-6-10-8(3)12(7-2)9(4)11(10)5/h9H,6-7H2,1-5H3
InChIKeyNQJFTXGPROINFI-UHFFFAOYSA-N
XLogP2.24
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-diethyl-2,3,5-trimethyl-2H-imidazole?
The IUPAC name of 1,4-diethyl-2,3,5-trimethyl-2H-imidazole (CID 70020663) is 1,4-diethyl-2,3,5-trimethyl-2H-imidazole.
What is the SMILES notation for 1,4-diethyl-2,3,5-trimethyl-2H-imidazole?
The canonical SMILES for 1,4-diethyl-2,3,5-trimethyl-2H-imidazole is CCC1=C(C)N(CC)C(C)N1C.
What is the InChIKey of 1,4-diethyl-2,3,5-trimethyl-2H-imidazole?
The InChIKey is NQJFTXGPROINFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-6-10-8(3)12(7-2)9(4)11(10)5/h9H,6-7H2,1-5H3.
What are the key properties of 1,4-diethyl-2,3,5-trimethyl-2H-imidazole?
1,4-diethyl-2,3,5-trimethyl-2H-imidazole has a molecular weight of 168.28 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-diethyl-2,3,5-trimethyl-2H-imidazole is sourced from PubChem (CID 70020663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).