1,3-bis(2-methylpropyl)-2H-imidazol-2-ol

C11H22N2O — CID 89024468

IUPAC1,3-bis(2-methylpropyl)-2H-imidazol-2-ol
SMILESCC(C)CN1C=CN(CC(C)C)C1O
InChIInChI=1S/C11H22N2O/c1-9(2)7-12-5-6-13(11(12)14)8-10(3)4/h5-6,9-11,14H,7-8H2,1-4H3
InChIKeyVUKXKWGVRZJMHV-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.66
Rot. Bonds4

About 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol

1,3-bis(2-methylpropyl)-2H-imidazol-2-ol (PubChem CID 89024468) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol.

Molecular Properties

Compound Name1,3-bis(2-methylpropyl)-2H-imidazol-2-ol
PubChem CID89024468
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1,3-bis(2-methylpropyl)-2H-imidazol-2-ol
SMILESCC(C)CN1C=CN(CC(C)C)C1O
InChIInChI=1S/C11H22N2O/c1-9(2)7-12-5-6-13(11(12)14)8-10(3)4/h5-6,9-11,14H,7-8H2,1-4H3
InChIKeyVUKXKWGVRZJMHV-UHFFFAOYSA-N
XLogP1.66
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1,3-bis(2-methylpropyl)-2H-imidazol-2-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 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol?
The IUPAC name of 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol (CID 89024468) is 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol.
What is the SMILES notation for 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol?
The canonical SMILES for 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol is CC(C)CN1C=CN(CC(C)C)C1O.
What is the InChIKey of 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol?
The InChIKey is VUKXKWGVRZJMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(2)7-12-5-6-13(11(12)14)8-10(3)4/h5-6,9-11,14H,7-8H2,1-4H3.
What are the key properties of 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol?
1,3-bis(2-methylpropyl)-2H-imidazol-2-ol has a molecular weight of 198.31 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(2-methylpropyl)-2H-imidazol-2-ol is sourced from PubChem (CID 89024468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).