5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole

C24H46N2 — CID 66722905

IUPAC5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole
SMILESCCCCCC(C)(C)c1nc(C(C)(C)CCCCC)c(C(C)(C)CC)[nH]1
InChIInChI=1S/C24H46N2/c1-10-13-15-17-23(6,7)20-19(22(4,5)12-3)25-21(26-20)24(8,9)18-16-14-11-2/h10-18H2,1-9H3,(H,25,26)
InChIKeyIBZPZNOUIDEWMR-UHFFFAOYSA-N
MW362.65 g/mol
LogP7.81
Rot. Bonds12

About 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole

5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole (PubChem CID 66722905) has the molecular formula C24H46N2 and a molecular weight of 362.65 g/mol. Its IUPAC name is 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole.

Molecular Properties

Compound Name5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole
PubChem CID66722905
Molecular FormulaC24H46N2
Molecular Weight362.65 g/mol
Exact Mass362.37
IUPAC Name5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole
SMILESCCCCCC(C)(C)c1nc(C(C)(C)CCCCC)c(C(C)(C)CC)[nH]1
InChIInChI=1S/C24H46N2/c1-10-13-15-17-23(6,7)20-19(22(4,5)12-3)25-21(26-20)24(8,9)18-16-14-11-2/h10-18H2,1-9H3,(H,25,26)
InChIKeyIBZPZNOUIDEWMR-UHFFFAOYSA-N
XLogP7.81
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.65
LogP ≤ 57.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-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

5-(2-methylbutan-2-yl)-4-(2-methylheptan-2-yl)-2-(3-methylpentan-3-yl)-1H-imidazole
CID 159059126
4-tert-butyl-5-(2-methylbutan-2-yl)-2-(2-methylhexan-2-yl)-1H-imidazole
CID 66723018
4-(2-methylheptan-2-yl)-5-(2-methylhexan-2-yl)-2-(3-methylpentan-3-yl)-1H-imidazole
CID 66723143
4-tert-butyl-2-(2-methylheptan-2-yl)-5-(3-methylpentan-3-yl)-1H-imidazole
CID 162062572
2-butyl-5-(2-methylbutan-2-yl)-4-(2-methylheptan-2-yl)-1H-imidazole
CID 174693367
2-tert-butyl-5-(2-methylhexan-2-yl)-4-(2-methylpentan-2-yl)-1H-imidazole
CID 66722943
2-(2-methylheptan-2-yl)-4-(2-methylhexan-2-yl)-5-propyl-1H-imidazole
CID 89497192
5-(3-methylbutan-2-yl)-4-(2-methylheptan-2-yl)-2-(3-methylpentan-3-yl)-1H-imidazole
CID 66722987
2-tert-butyl-4-(2-methylbutan-2-yl)-5-(3-methylpentan-3-yl)-1H-imidazole
CID 66723586
4-(2-methylhexan-2-yl)-2-(3-methylpentan-3-yl)-5-propan-2-yl-1H-imidazole
CID 66723308
5-(3-methylbutan-2-yl)-2-(2-methylheptan-2-yl)-1H-imidazole
CID 152581875
2,4-bis(2-methylpentan-2-yl)-5-pentan-2-yl-1H-imidazole
CID 66723300

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole?
The IUPAC name of 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole (CID 66722905) is 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole.
What is the SMILES notation for 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole?
The canonical SMILES for 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole is CCCCCC(C)(C)c1nc(C(C)(C)CCCCC)c(C(C)(C)CC)[nH]1.
What is the InChIKey of 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole?
The InChIKey is IBZPZNOUIDEWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46N2/c1-10-13-15-17-23(6,7)20-19(22(4,5)12-3)25-21(26-20)24(8,9)18-16-14-11-2/h10-18H2,1-9H3,(H,25,26).
What are the key properties of 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole?
5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole has a molecular weight of 362.65 g/mol, XLogP of 7.81, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylbutan-2-yl)-2,4-bis(2-methylheptan-2-yl)-1H-imidazole is sourced from PubChem (CID 66722905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).