2-butyl-5-methyl-1H-imidazol-4-ol

C8H14N2O — CID 67585569

IUPAC2-butyl-5-methyl-1H-imidazol-4-ol
SMILESCCCCc1nc(O)c(C)[nH]1
InChIInChI=1S/C8H14N2O/c1-3-4-5-7-9-6(2)8(11)10-7/h11H,3-5H2,1-2H3,(H,9,10)
InChIKeyYTVBJBOINGDROH-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.77
Rot. Bonds3

About 2-butyl-5-methyl-1H-imidazol-4-ol

2-butyl-5-methyl-1H-imidazol-4-ol (PubChem CID 67585569) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-butyl-5-methyl-1H-imidazol-4-ol.

Molecular Properties

Compound Name2-butyl-5-methyl-1H-imidazol-4-ol
PubChem CID67585569
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2-butyl-5-methyl-1H-imidazol-4-ol
SMILESCCCCc1nc(O)c(C)[nH]1
InChIInChI=1S/C8H14N2O/c1-3-4-5-7-9-6(2)8(11)10-7/h11H,3-5H2,1-2H3,(H,9,10)
InChIKeyYTVBJBOINGDROH-UHFFFAOYSA-N
XLogP1.77
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-butyl-5-methyl-1H-imidazol-4-ol 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 2-butyl-5-methyl-1H-imidazol-4-ol?
The IUPAC name of 2-butyl-5-methyl-1H-imidazol-4-ol (CID 67585569) is 2-butyl-5-methyl-1H-imidazol-4-ol.
What is the SMILES notation for 2-butyl-5-methyl-1H-imidazol-4-ol?
The canonical SMILES for 2-butyl-5-methyl-1H-imidazol-4-ol is CCCCc1nc(O)c(C)[nH]1.
What is the InChIKey of 2-butyl-5-methyl-1H-imidazol-4-ol?
The InChIKey is YTVBJBOINGDROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-3-4-5-7-9-6(2)8(11)10-7/h11H,3-5H2,1-2H3,(H,9,10).
What are the key properties of 2-butyl-5-methyl-1H-imidazol-4-ol?
2-butyl-5-methyl-1H-imidazol-4-ol has a molecular weight of 154.21 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-5-methyl-1H-imidazol-4-ol is sourced from PubChem (CID 67585569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).