1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole

C11H16N4 — CID 67392091

IUPAC1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
SMILESCn1ccnc1CCCc1nccn1C
InChIInChI=1S/C11H16N4/c1-14-8-6-12-10(14)4-3-5-11-13-7-9-15(11)2/h6-9H,3-5H2,1-2H3
InChIKeyWJFFMHSLCJKDEN-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.33
Rot. Bonds4

About 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole

1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole (PubChem CID 67392091) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole.

Molecular Properties

Compound Name1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
PubChem CID67392091
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
SMILESCn1ccnc1CCCc1nccn1C
InChIInChI=1S/C11H16N4/c1-14-8-6-12-10(14)4-3-5-11-13-7-9-15(11)2/h6-9H,3-5H2,1-2H3
InChIKeyWJFFMHSLCJKDEN-UHFFFAOYSA-N
XLogP1.33
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole 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

1-methyl-2-nonylimidazole
CID 67393993
4-(1-methylimidazol-2-yl)butan-1-amine
CID 79762041
1-methyl-2-pentadecylimidazole
CID 68899434
N-methyl-4-(1-methylimidazol-2-yl)butan-1-amine
CID 79762044
2-butyl-1-methylimidazole;fluoroform
CID 162050255
alumane;2-hexyl-1-methylimidazole;tetrahydrochloride
CID 174887731
azane;1-methyl-2-propylimidazole
CID 174525892
2-(4-bromopentyl)-1-methylimidazole
CID 79761341
methanamine;1-methyl-2-propylimidazole
CID 164902083
3-(1-methylimidazol-2-yl)-N-propylpropan-1-amine
CID 64503736
2-butyl-1-methylimidazole;propan-2-ol;hydrochloride
CID 175427574
2-(5-bromohexyl)-1-methylimidazole
CID 114532192

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole?
The IUPAC name of 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole (CID 67392091) is 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole.
What is the SMILES notation for 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole?
The canonical SMILES for 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole is Cn1ccnc1CCCc1nccn1C.
What is the InChIKey of 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole?
The InChIKey is WJFFMHSLCJKDEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-14-8-6-12-10(14)4-3-5-11-13-7-9-15(11)2/h6-9H,3-5H2,1-2H3.
What are the key properties of 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole?
1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole has a molecular weight of 204.28 g/mol, XLogP of 1.33, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole is sourced from PubChem (CID 67392091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).