2,5-dimethyl-1H-imidazol-4-ol

C5H8N2O — CID 54265485

IUPAC2,5-dimethyl-1H-imidazol-4-ol
SMILESCc1nc(O)c(C)[nH]1
InChIInChI=1S/C5H8N2O/c1-3-5(8)7-4(2)6-3/h8H,1-2H3,(H,6,7)
InChIKeyRGLLHIYSHSJSJM-UHFFFAOYSA-N
MW112.13 g/mol
LogP0.73
Rot. Bonds

About 2,5-dimethyl-1H-imidazol-4-ol

2,5-dimethyl-1H-imidazol-4-ol (PubChem CID 54265485) has the molecular formula C5H8N2O and a molecular weight of 112.13 g/mol. Its IUPAC name is 2,5-dimethyl-1H-imidazol-4-ol.

Molecular Properties

Compound Name2,5-dimethyl-1H-imidazol-4-ol
PubChem CID54265485
Molecular FormulaC5H8N2O
Molecular Weight112.13 g/mol
Exact Mass112.06
IUPAC Name2,5-dimethyl-1H-imidazol-4-ol
SMILESCc1nc(O)c(C)[nH]1
InChIInChI=1S/C5H8N2O/c1-3-5(8)7-4(2)6-3/h8H,1-2H3,(H,6,7)
InChIKeyRGLLHIYSHSJSJM-UHFFFAOYSA-N
XLogP0.73
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.13
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4,5-dimethyl-1H-imidazol-2-yl)methanol
CID 46784770
4-methyl-1H-imidazol-5-ol
CID 54352844
5-(Aminomethylidene)imidazol-4-one
CID 135768762
2-methyl-5-(trifluoromethyl)-1H-imidazol-4-ol
CID 70606121
Methyl-dihydroxy propyl imidazolium chloride
CID 134612656
5-methyl-2-(3,3,3-trifluoropropyl)-1H-imidazol-4-ol
CID 133628376
5-propan-2-yl-2-(2,2,2-trifluoroethyl)-1H-imidazol-4-ol
CID 133637991
1,2,5-Trimethylimidazol-4-ol
CID 12306263
4-methoxy-2,5-dimethyl-1H-imidazole
CID 13085889
2-[(4-hydroxy-5-methyl-1H-imidazol-2-yl)-methylamino]acetic acid
CID 15897872
2-amino-5-propan-2-yl-1H-imidazol-4-ol
CID 45075983
2-(2-aminoethyl)-5-methyl-1H-imidazol-4-ol
CID 53800192

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1H-imidazol-4-ol?
The IUPAC name of 2,5-dimethyl-1H-imidazol-4-ol (CID 54265485) is 2,5-dimethyl-1H-imidazol-4-ol.
What is the SMILES notation for 2,5-dimethyl-1H-imidazol-4-ol?
The canonical SMILES for 2,5-dimethyl-1H-imidazol-4-ol is Cc1nc(O)c(C)[nH]1.
What is the InChIKey of 2,5-dimethyl-1H-imidazol-4-ol?
The InChIKey is RGLLHIYSHSJSJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O/c1-3-5(8)7-4(2)6-3/h8H,1-2H3,(H,6,7).
What are the key properties of 2,5-dimethyl-1H-imidazol-4-ol?
2,5-dimethyl-1H-imidazol-4-ol has a molecular weight of 112.13 g/mol, XLogP of 0.73, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1H-imidazol-4-ol is sourced from PubChem (CID 54265485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).