1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole

C9H16N2 — CID 123619895

IUPAC1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole
SMILESCC=CC1=NC(C)CN1CC
InChIInChI=1S/C9H16N2/c1-4-6-9-10-8(3)7-11(9)5-2/h4,6,8H,5,7H2,1-3H3
InChIKeyJMIZQADLLQDDQB-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.68
Rot. Bonds2

About 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole

1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole (PubChem CID 123619895) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole
PubChem CID123619895
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole
SMILESCC=CC1=NC(C)CN1CC
InChIInChI=1S/C9H16N2/c1-4-6-9-10-8(3)7-11(9)5-2/h4,6,8H,5,7H2,1-3H3
InChIKeyJMIZQADLLQDDQB-UHFFFAOYSA-N
XLogP1.68
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole?
The IUPAC name of 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole (CID 123619895) is 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole.
What is the SMILES notation for 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole?
The canonical SMILES for 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole is CC=CC1=NC(C)CN1CC.
What is the InChIKey of 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole?
The InChIKey is JMIZQADLLQDDQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-6-9-10-8(3)7-11(9)5-2/h4,6,8H,5,7H2,1-3H3.
What are the key properties of 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole?
1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole has a molecular weight of 152.24 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-methyl-2-prop-1-enyl-4,5-dihydroimidazole is sourced from PubChem (CID 123619895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).