1-methyl-4,5-dihydroimidazole

C4H8N2 — CID 3744783

IUPAC1-methyl-4,5-dihydroimidazole
SMILESCN1C=NCC1
InChIInChI=1S/C4H8N2/c1-6-3-2-5-4-6/h4H,2-3H2,1H3
InChIKeyANFXTILBDGTSEG-UHFFFAOYSA-N
MW84.12 g/mol
LogP-0.04
Rot. Bonds

About 1-methyl-4,5-dihydroimidazole

1-methyl-4,5-dihydroimidazole (PubChem CID 3744783) has the molecular formula C4H8N2 and a molecular weight of 84.12 g/mol. Its IUPAC name is 1-methyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-methyl-4,5-dihydroimidazole
PubChem CID3744783
Molecular FormulaC4H8N2
Molecular Weight84.12 g/mol
Exact Mass84.07
IUPAC Name1-methyl-4,5-dihydroimidazole
SMILESCN1C=NCC1
InChIInChI=1S/C4H8N2/c1-6-3-2-5-4-6/h4H,2-3H2,1H3
InChIKeyANFXTILBDGTSEG-UHFFFAOYSA-N
XLogP-0.04
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.12
LogP ≤ 5-0.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-methyl-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

Related Compounds

N'-(Dimethylaminoethyl)-N,N-dimethylformamidine
CID 58281
2-Chloro-1,3-dimethylimidazolinium chloride
CID 10176306
2-Chloro-1,3-dimethylimidazolinium
CID 4176750
2-Fluoro-1,3-dimethyl-4,5-dihydroimidazol-1-ium
CID 2779127
Ethyl imidazoline
CID 485092
1-Butyl-4,5-dihydro-1H-imidazole
CID 12386885
Propylimidazoline
CID 18667842
2-Imidazolinecarbonitrile
CID 19933486
1,3-Dimethyl-4,5-dihydroimidazol-1-ium
CID 20238538
2-Iodo-1,3-dimethyl-4,5-dihydroimidazol-1-ium
CID 20596621
1,1-Dimethyl-4,5-dihydroimidazol-1-ium
CID 21977283
1,3-dimethyl-4,5-dihydro-2H-imidazol-1-ium-2-ide
CID 59380814

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4,5-dihydroimidazole?
The IUPAC name of 1-methyl-4,5-dihydroimidazole (CID 3744783) is 1-methyl-4,5-dihydroimidazole.
What is the SMILES notation for 1-methyl-4,5-dihydroimidazole?
The canonical SMILES for 1-methyl-4,5-dihydroimidazole is CN1C=NCC1.
What is the InChIKey of 1-methyl-4,5-dihydroimidazole?
The InChIKey is ANFXTILBDGTSEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2/c1-6-3-2-5-4-6/h4H,2-3H2,1H3.
What are the key properties of 1-methyl-4,5-dihydroimidazole?
1-methyl-4,5-dihydroimidazole has a molecular weight of 84.12 g/mol, XLogP of -0.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4,5-dihydroimidazole is sourced from PubChem (CID 3744783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).