1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole

C15H22N4 — CID 56716278

IUPAC1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole
SMILESCCCC1(Cn2ccnc2-c2nccn2C)CCC1
InChIInChI=1S/C15H22N4/c1-3-5-15(6-4-7-15)12-19-11-9-17-14(19)13-16-8-10-18(13)2/h8-11H,3-7,12H2,1-2H3
InChIKeyRJFINYIAEXVPMO-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.25
Rot. Bonds5

About 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole

1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole (PubChem CID 56716278) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole.

Molecular Properties

Compound Name1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole
PubChem CID56716278
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole
SMILESCCCC1(Cn2ccnc2-c2nccn2C)CCC1
InChIInChI=1S/C15H22N4/c1-3-5-15(6-4-7-15)12-19-11-9-17-14(19)13-16-8-10-18(13)2/h8-11H,3-7,12H2,1-2H3
InChIKeyRJFINYIAEXVPMO-UHFFFAOYSA-N
XLogP3.25
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole 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-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole?
The IUPAC name of 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole (CID 56716278) is 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole.
What is the SMILES notation for 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole?
The canonical SMILES for 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole is CCCC1(Cn2ccnc2-c2nccn2C)CCC1.
What is the InChIKey of 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole?
The InChIKey is RJFINYIAEXVPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-3-5-15(6-4-7-15)12-19-11-9-17-14(19)13-16-8-10-18(13)2/h8-11H,3-7,12H2,1-2H3.
What are the key properties of 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole?
1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole has a molecular weight of 258.37 g/mol, XLogP of 3.25, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[1-[(1-propylcyclobutyl)methyl]imidazol-2-yl]imidazole is sourced from PubChem (CID 56716278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).