(1-methyl-4,5-dihydroimidazol-2-yl)methanol

C5H10N2O — CID 13144026

IUPAC(1-methyl-4,5-dihydroimidazol-2-yl)methanol
SMILESCN1CCN=C1CO
InChIInChI=1S/C5H10N2O/c1-7-3-2-6-5(7)4-8/h8H,2-4H2,1H3
InChIKeyCAHMASYDKPXLIC-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.68
Rot. Bonds1

About (1-methyl-4,5-dihydroimidazol-2-yl)methanol

(1-methyl-4,5-dihydroimidazol-2-yl)methanol (PubChem CID 13144026) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is (1-methyl-4,5-dihydroimidazol-2-yl)methanol.

Molecular Properties

Compound Name(1-methyl-4,5-dihydroimidazol-2-yl)methanol
PubChem CID13144026
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name(1-methyl-4,5-dihydroimidazol-2-yl)methanol
SMILESCN1CCN=C1CO
InChIInChI=1S/C5H10N2O/c1-7-3-2-6-5(7)4-8/h8H,2-4H2,1H3
InChIKeyCAHMASYDKPXLIC-UHFFFAOYSA-N
XLogP-0.68
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1-methyl-4,5-dihydroimidazol-2-yl)methanol 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-methyl-4,5-dihydroimidazol-2-yl)methanol?
The IUPAC name of (1-methyl-4,5-dihydroimidazol-2-yl)methanol (CID 13144026) is (1-methyl-4,5-dihydroimidazol-2-yl)methanol.
What is the SMILES notation for (1-methyl-4,5-dihydroimidazol-2-yl)methanol?
The canonical SMILES for (1-methyl-4,5-dihydroimidazol-2-yl)methanol is CN1CCN=C1CO.
What is the InChIKey of (1-methyl-4,5-dihydroimidazol-2-yl)methanol?
The InChIKey is CAHMASYDKPXLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-7-3-2-6-5(7)4-8/h8H,2-4H2,1H3.
What are the key properties of (1-methyl-4,5-dihydroimidazol-2-yl)methanol?
(1-methyl-4,5-dihydroimidazol-2-yl)methanol has a molecular weight of 114.15 g/mol, XLogP of -0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-4,5-dihydroimidazol-2-yl)methanol is sourced from PubChem (CID 13144026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).