2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol

C8H8N4O — CID 137273176

IUPAC2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol
SMILESCc1nccc(-c2ncc(O)[nH]2)n1
InChIInChI=1S/C8H8N4O/c1-5-9-3-2-6(11-5)8-10-4-7(13)12-8/h2-4,13H,1H3,(H,10,12)
InChIKeyGXFOPBFKKQQAPJ-UHFFFAOYSA-N
MW176.18 g/mol
LogP0.88
Rot. Bonds1

About 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol

2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol (PubChem CID 137273176) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol.

Molecular Properties

Compound Name2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol
PubChem CID137273176
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol
SMILESCc1nccc(-c2ncc(O)[nH]2)n1
InChIInChI=1S/C8H8N4O/c1-5-9-3-2-6(11-5)8-10-4-7(13)12-8/h2-4,13H,1H3,(H,10,12)
InChIKeyGXFOPBFKKQQAPJ-UHFFFAOYSA-N
XLogP0.88
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(ethylaminomethyl)-2-(2-methylpyrimidin-4-yl)-1H-pyrimidin-6-one
CID 114206220
3-(2-methylpyrimidin-4-yl)-1,4-dihydro-1,2,4-triazol-5-one
CID 137012896
5-bromo-4-hydroxy-2-(2-methylpyrimidin-4-yl)-1H-pyrimidin-6-one
CID 115527441
4-amino-5-ethyl-2-(2-methylpyrimidin-4-yl)-1H-pyrimidin-6-one
CID 136967413
2-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydro-1H-quinazoline-4-thione
CID 106477174
4,6-dimethyl-2-(2-methylpyrimidin-4-yl)pyrimidine-5-carboxylic acid
CID 113329643
2-methyl-4-(1H-pyrrol-2-yl)pyrimidine
CID 116903909
2-methyl-4-pyrimidin-4-ylpyrimidine
CID 54062248
2-hydroxy-3-(2-methylpyrimidin-4-yl)cyclohepta-2,4,6-trien-1-one
CID 174169493
5-bromo-6-cyclopentyl-2-(2-methylpyrimidin-4-yl)-1H-pyrimidine-4-thione
CID 106482123
2-methyl-4-(2-methyl-4-pyridinyl)pyrimidine
CID 71302575
2-methyl-4-(3-propan-2-ylimidazol-4-yl)pyrimidine
CID 145049102

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol?
The IUPAC name of 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol (CID 137273176) is 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol.
What is the SMILES notation for 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol?
The canonical SMILES for 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol is Cc1nccc(-c2ncc(O)[nH]2)n1.
What is the InChIKey of 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol?
The InChIKey is GXFOPBFKKQQAPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c1-5-9-3-2-6(11-5)8-10-4-7(13)12-8/h2-4,13H,1H3,(H,10,12).
What are the key properties of 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol?
2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol has a molecular weight of 176.18 g/mol, XLogP of 0.88, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrimidin-4-yl)-1H-imidazol-5-ol is sourced from PubChem (CID 137273176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).