5-(2-methylpropyl)-1H-imidazol-4-ol

C7H12N2O — CID 57091779

IUPAC5-(2-methylpropyl)-1H-imidazol-4-ol
SMILESCC(C)Cc1[nH]cnc1O
InChIInChI=1S/C7H12N2O/c1-5(2)3-6-7(10)9-4-8-6/h4-5,10H,3H2,1-2H3,(H,8,9)
InChIKeyZPNAVUVLTBYLSP-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.31
Rot. Bonds2

About 5-(2-methylpropyl)-1H-imidazol-4-ol

5-(2-methylpropyl)-1H-imidazol-4-ol (PubChem CID 57091779) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 5-(2-methylpropyl)-1H-imidazol-4-ol.

Molecular Properties

Compound Name5-(2-methylpropyl)-1H-imidazol-4-ol
PubChem CID57091779
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name5-(2-methylpropyl)-1H-imidazol-4-ol
SMILESCC(C)Cc1[nH]cnc1O
InChIInChI=1S/C7H12N2O/c1-5(2)3-6-7(10)9-4-8-6/h4-5,10H,3H2,1-2H3,(H,8,9)
InChIKeyZPNAVUVLTBYLSP-UHFFFAOYSA-N
XLogP1.31
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-6-(2-methylpropyl)-1H-pyrimidine-4-thione
CID 106517843
5-methyl-1H-imidazol-4-ol
CID 54352844
(4-propan-2-yl-1H-imidazol-5-yl)methanol
CID 12615462
4-amino-5-(2-methylpropyl)-1H-pyrimidin-6-one
CID 135991796
5-(4-hydroxy-1H-imidazol-5-yl)-1H-imidazol-4-ol
CID 57358885
6-(2-methylpropyl)-1H-pyrimidine-4-thione
CID 106481376
2-[4-[4-(2-methylpropyl)phenyl]-1H-imidazol-5-yl]ethanamine
CID 95456243
5-(2-methylpropyl)-1H-imidazo[4,5-b]pyridine
CID 130420830
4-(2-methylpropyl)-1H-imidazo[4,5-c]pyridine
CID 173346050
1-(7H-purin-6-yl)propan-2-ol
CID 174759958
4-methyl-5-(2-methylpropyl)-1H-pyrazole
CID 3805989
2-(2-methylpropyl)-1H-imidazole;dihydrochloride
CID 170357804

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-1H-imidazol-4-ol?
The IUPAC name of 5-(2-methylpropyl)-1H-imidazol-4-ol (CID 57091779) is 5-(2-methylpropyl)-1H-imidazol-4-ol.
What is the SMILES notation for 5-(2-methylpropyl)-1H-imidazol-4-ol?
The canonical SMILES for 5-(2-methylpropyl)-1H-imidazol-4-ol is CC(C)Cc1[nH]cnc1O.
What is the InChIKey of 5-(2-methylpropyl)-1H-imidazol-4-ol?
The InChIKey is ZPNAVUVLTBYLSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-5(2)3-6-7(10)9-4-8-6/h4-5,10H,3H2,1-2H3,(H,8,9).
What are the key properties of 5-(2-methylpropyl)-1H-imidazol-4-ol?
5-(2-methylpropyl)-1H-imidazol-4-ol has a molecular weight of 140.19 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-1H-imidazol-4-ol is sourced from PubChem (CID 57091779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).