2-(2-imidazol-1-ylpropyl)-1-methylimidazole

C10H14N4 — CID 90975843

IUPAC2-(2-imidazol-1-ylpropyl)-1-methylimidazole
SMILESCC(Cc1nccn1C)n1ccnc1
InChIInChI=1S/C10H14N4/c1-9(14-6-3-11-8-14)7-10-12-4-5-13(10)2/h3-6,8-9H,7H2,1-2H3
InChIKeyDFPIBSGOZACKIT-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.42
Rot. Bonds3

About 2-(2-imidazol-1-ylpropyl)-1-methylimidazole

2-(2-imidazol-1-ylpropyl)-1-methylimidazole (PubChem CID 90975843) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-(2-imidazol-1-ylpropyl)-1-methylimidazole.

Molecular Properties

Compound Name2-(2-imidazol-1-ylpropyl)-1-methylimidazole
PubChem CID90975843
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name2-(2-imidazol-1-ylpropyl)-1-methylimidazole
SMILESCC(Cc1nccn1C)n1ccnc1
InChIInChI=1S/C10H14N4/c1-9(14-6-3-11-8-14)7-10-12-4-5-13(10)2/h3-6,8-9H,7H2,1-2H3
InChIKeyDFPIBSGOZACKIT-UHFFFAOYSA-N
XLogP1.42
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-imidazol-1-ylpropyl)-1-methylimidazole 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

2-(3-bromo-2-methylpropyl)-1-methylimidazole
CID 64671780
2-methyl-3-(1-methylimidazol-2-yl)-N-(2-methylpropyl)propan-1-amine
CID 64664391
N-ethyl-2-methyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 64666233
1-methylimidazole;(2S)-1-(1-methylimidazol-2-yl)propan-2-ol;(2S)-2-methyloxirane
CID 159455593
1-methyl-2-(3-methylbutyl)imidazole
CID 68983412
N-[(1-methylimidazol-2-yl)methyl]imidazole-1-carboxamide
CID 63295768
1,1-diethoxy-3-(1-methylimidazol-2-yl)propan-2-ol
CID 79753127
1-(1-methylimidazol-2-yl)-3-pyridin-4-ylpropan-2-ol
CID 79752618
2-(2-bromopentyl)-1-methylimidazole
CID 63203989
3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine
CID 115580390
1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
CID 67392091
2-(fluoromethyl)-1-methylimidazole
CID 11679811

Frequently Asked Questions

What is the IUPAC name of 2-(2-imidazol-1-ylpropyl)-1-methylimidazole?
The IUPAC name of 2-(2-imidazol-1-ylpropyl)-1-methylimidazole (CID 90975843) is 2-(2-imidazol-1-ylpropyl)-1-methylimidazole.
What is the SMILES notation for 2-(2-imidazol-1-ylpropyl)-1-methylimidazole?
The canonical SMILES for 2-(2-imidazol-1-ylpropyl)-1-methylimidazole is CC(Cc1nccn1C)n1ccnc1.
What is the InChIKey of 2-(2-imidazol-1-ylpropyl)-1-methylimidazole?
The InChIKey is DFPIBSGOZACKIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-9(14-6-3-11-8-14)7-10-12-4-5-13(10)2/h3-6,8-9H,7H2,1-2H3.
What are the key properties of 2-(2-imidazol-1-ylpropyl)-1-methylimidazole?
2-(2-imidazol-1-ylpropyl)-1-methylimidazole has a molecular weight of 190.25 g/mol, XLogP of 1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-imidazol-1-ylpropyl)-1-methylimidazole is sourced from PubChem (CID 90975843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).