3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol

C11H20N2O — CID 130518784

IUPAC3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol
SMILESCCC(O)(c1cnc(C)n1C)C(C)C
InChIInChI=1S/C11H20N2O/c1-6-11(14,8(2)3)10-7-12-9(4)13(10)5/h7-8,14H,6H2,1-5H3
InChIKeyBITVOYHFZPYTMA-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.98
Rot. Bonds3

About 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol

3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol (PubChem CID 130518784) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol.

Molecular Properties

Compound Name3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol
PubChem CID130518784
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol
SMILESCCC(O)(c1cnc(C)n1C)C(C)C
InChIInChI=1S/C11H20N2O/c1-6-11(14,8(2)3)10-7-12-9(4)13(10)5/h7-8,14H,6H2,1-5H3
InChIKeyBITVOYHFZPYTMA-UHFFFAOYSA-N
XLogP1.98
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol 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

2-(1-methyl-1H-imidazol-5-yl)propan-2-ol
CID 84648525
1-Fluoro-3-[2-methyl-5-(2-methylcyclopropyl)imidazol-1-yl]propan-2-ol
CID 123272110
Tris(2-ethyl-1-methylimidazol-4-yl)methanol
CID 91150698
(E)-2-(2-chloro-3-methylimidazol-4-yl)-3-methylpent-3-en-2-ol
CID 101766392
1-[2-(2-fluoropropan-2-yl)-1H-imidazol-5-yl]cyclopropan-1-ol
CID 84769383
2-(1-Ethylimidazol-4-yl)-6,6,6-trifluorohexan-2-ol
CID 114272606
3-Amino-2-(1-ethylimidazol-4-yl)-1,1,1-trifluoropentan-2-ol
CID 114272808
3-Amino-2-(2,3-dimethylimidazol-4-yl)-1,1,1-trifluoropentan-2-ol
CID 114283471
1-(2,3-Dimethylimidazol-4-yl)-2,2-difluoropropan-1-ol
CID 130641811
2-(1,2-Dimethylimidazol-4-yl)propan-2-ol
CID 10997253
2,2-Dimethyl-1-(3-methylimidazol-4-yl)propan-1-ol
CID 10329713
2-(1-methyl-1H-imidazol-4-yl)propan-2-ol
CID 12519701

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol?
The IUPAC name of 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol (CID 130518784) is 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol.
What is the SMILES notation for 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol?
The canonical SMILES for 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol is CCC(O)(c1cnc(C)n1C)C(C)C.
What is the InChIKey of 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol?
The InChIKey is BITVOYHFZPYTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-6-11(14,8(2)3)10-7-12-9(4)13(10)5/h7-8,14H,6H2,1-5H3.
What are the key properties of 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol?
3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol has a molecular weight of 196.29 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylimidazol-4-yl)-2-methylpentan-3-ol is sourced from PubChem (CID 130518784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).