4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole

C17H24N2 — CID 167066375

IUPAC4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole
SMILESCCCc1nc(C)c(-c2ccccc2)n1CC(C)C
InChIInChI=1S/C17H24N2/c1-5-9-16-18-14(4)17(19(16)12-13(2)3)15-10-7-6-8-11-15/h6-8,10-11,13H,5,9,12H2,1-4H3
InChIKeyHZXHQBSLJWEJMT-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.47
Rot. Bonds5

About 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole

4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole (PubChem CID 167066375) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole.

Molecular Properties

Compound Name4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole
PubChem CID167066375
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole
SMILESCCCc1nc(C)c(-c2ccccc2)n1CC(C)C
InChIInChI=1S/C17H24N2/c1-5-9-16-18-14(4)17(19(16)12-13(2)3)15-10-7-6-8-11-15/h6-8,10-11,13H,5,9,12H2,1-4H3
InChIKeyHZXHQBSLJWEJMT-UHFFFAOYSA-N
XLogP4.47
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-Diphenyl-2-methylimidazole
CID 236696
1-benzyl-5-phenyl-1H-imidazole
CID 10444038
1-Benzyl-2-phenylbenzimidazole
CID 1221687
1-Benzyl-2-methylbenzimidazole
CID 759305
2-Cyclohexyl-1-methylbenzimidazole
CID 2991075
1-methyl-2-(2-phenylvinyl)-1H-benzimidazole
CID 5708370
1-Methyl-5-phenyl-imidazol-2-amine
CID 1132927
1,2-dibenzyl-1H-1,3-benzodiazole
CID 1350539
1-Methyl-5-phenyl-1H-imidazole
CID 3746343
2-Hexyl-5-[4-(2-methylpropyl)phenyl]-1H-imidazole
CID 9795821
5-phenyl-2-undecan-6-yl-1H-imidazole
CID 9944114
5-[3-(1H-imidazol-1-yl)propyl]-7,8-dihydroquinoline
CID 10586086

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole?
The IUPAC name of 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole (CID 167066375) is 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole.
What is the SMILES notation for 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole?
The canonical SMILES for 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole is CCCc1nc(C)c(-c2ccccc2)n1CC(C)C.
What is the InChIKey of 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole?
The InChIKey is HZXHQBSLJWEJMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-5-9-16-18-14(4)17(19(16)12-13(2)3)15-10-7-6-8-11-15/h6-8,10-11,13H,5,9,12H2,1-4H3.
What are the key properties of 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole?
4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole has a molecular weight of 256.39 g/mol, XLogP of 4.47, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-methylpropyl)-5-phenyl-2-propylimidazole is sourced from PubChem (CID 167066375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).