1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole

C14H14N4 — CID 1088925

IUPAC1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole
SMILESCn1ccnc1-c1ccc(-c2nccn2C)cc1
InChIInChI=1S/C14H14N4/c1-17-9-7-15-13(17)11-3-5-12(6-4-11)14-16-8-10-18(14)2/h3-10H,1-2H3
InChIKeyGUCKHUJQQHTHCC-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.49
Rot. Bonds2

About 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole

1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole (PubChem CID 1088925) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole.

Molecular Properties

Compound Name1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole
PubChem CID1088925
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole
SMILESCn1ccnc1-c1ccc(-c2nccn2C)cc1
InChIInChI=1S/C14H14N4/c1-17-9-7-15-13(17)11-3-5-12(6-4-11)14-16-8-10-18(14)2/h3-10H,1-2H3
InChIKeyGUCKHUJQQHTHCC-UHFFFAOYSA-N
XLogP2.49
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-2-[4-[4-(1-methylimidazol-2-yl)phenyl]phenyl]imidazole
CID 132575754
ethane;1-methyl-2-phenylimidazole
CID 142155183
4-(1-methylimidazol-2-yl)benzoic acid
CID 23009409
2-[4-(1-methylimidazol-2-yl)phenyl]acetonitrile
CID 84774362
2-(4-chloro-3-methylphenyl)-1-methylimidazole
CID 172691387
bis(1-methyl-2-phenylimidazole);pentane
CID 134304641
2-[4-(1-methylimidazol-2-yl)phenyl]propanoic acid
CID 117332408
1-[4-(1-methylimidazol-2-yl)phenyl]cyclobutan-1-amine
CID 117327419
2-hydroxy-2-[4-(1-methylimidazol-2-yl)phenyl]acetic acid
CID 117335940
2-bromo-1-methylimidazole;4-(1-methylimidazol-2-yl)benzonitrile
CID 159023503
2-(3-chlorophenyl)-1-methylimidazole
CID 57277272
4-[[4-(1-methylimidazol-2-yl)phenyl]methyl]piperidine
CID 117391867

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole?
The IUPAC name of 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole (CID 1088925) is 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole.
What is the SMILES notation for 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole?
The canonical SMILES for 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole is Cn1ccnc1-c1ccc(-c2nccn2C)cc1.
What is the InChIKey of 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole?
The InChIKey is GUCKHUJQQHTHCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-17-9-7-15-13(17)11-3-5-12(6-4-11)14-16-8-10-18(14)2/h3-10H,1-2H3.
What are the key properties of 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole?
1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole has a molecular weight of 238.29 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole is sourced from PubChem (CID 1088925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).