2,4,5-triethyl-1H-imidazole

C9H16N2 — CID 19377935

IUPAC2,4,5-triethyl-1H-imidazole
SMILESCCc1nc(CC)c(CC)[nH]1
InChIInChI=1S/C9H16N2/c1-4-7-8(5-2)11-9(6-3)10-7/h4-6H2,1-3H3,(H,10,11)
InChIKeyCMAMPIMEOWYCDC-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.10
Rot. Bonds3

About 2,4,5-triethyl-1H-imidazole

2,4,5-triethyl-1H-imidazole (PubChem CID 19377935) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 2,4,5-triethyl-1H-imidazole.

Molecular Properties

Compound Name2,4,5-triethyl-1H-imidazole
PubChem CID19377935
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name2,4,5-triethyl-1H-imidazole
SMILESCCc1nc(CC)c(CC)[nH]1
InChIInChI=1S/C9H16N2/c1-4-7-8(5-2)11-9(6-3)10-7/h4-6H2,1-3H3,(H,10,11)
InChIKeyCMAMPIMEOWYCDC-UHFFFAOYSA-N
XLogP2.10
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-triethyl-1H-imidazole?
The IUPAC name of 2,4,5-triethyl-1H-imidazole (CID 19377935) is 2,4,5-triethyl-1H-imidazole.
What is the SMILES notation for 2,4,5-triethyl-1H-imidazole?
The canonical SMILES for 2,4,5-triethyl-1H-imidazole is CCc1nc(CC)c(CC)[nH]1.
What is the InChIKey of 2,4,5-triethyl-1H-imidazole?
The InChIKey is CMAMPIMEOWYCDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-7-8(5-2)11-9(6-3)10-7/h4-6H2,1-3H3,(H,10,11).
What are the key properties of 2,4,5-triethyl-1H-imidazole?
2,4,5-triethyl-1H-imidazole has a molecular weight of 152.24 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-triethyl-1H-imidazole is sourced from PubChem (CID 19377935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).